Isosulfan Blue Inner Salt

Isosulfan Blue Inner Salt

SCHEMBL866914

CCN(CC)c1ccc(C(=C2C=CC(=[N+](CC)CC)C=C2)c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)cc1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 3/20 0.66
▸ TLR9 Q9NR96 1/20 0.66
▸ NSD2 O96028 1/20 0.62
▸ G6PD P11413 1/20 0.62
▸ CDK5 Q00535 1/20 0.62
▸ CDK5R1 Q15078 1/20 0.62
▸ MEN1 O00255 5/20 0.60
▸ KMT2A Q03164 5/20 0.60
▸ TDP1 Q9NUW8 4/20 0.60
▸ THRB P10828 4/20 0.60
▸ RECQL P46063 2/20 0.60
▸ BLM P54132 2/20 0.60
▸ APEX1 P27695 1/20 0.60
▸ HDAC6 Q9UBN7 2/20 0.58
▸ MAPT P10636 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Isosulfan Blue Inner Salt SCHEMBL30876833 1.00 HSP90AA1 (0.66) HSP90AA1TLR9NSD2G6PDCDK5
Isosulfan Blue Inner Salt SCHEMBL29683989 0.99 HSP90AA1 (0.64) HSP90AA1TLR9NSD2G6PDCDK5
Isosulfan Blue Inner Salt SCHEMBL31244567 0.99 HSP90AA1 (0.64) HSP90AA1TLR9NSD2G6PDCDK5
Isosulfan Blue Inner Salt SCHEMBL30876834 0.94 HSP90AA1 (0.66) HSP90AA1TLR9NSD2G6PDCDK5
Isosulfan Blue Inner Salt SCHEMBL180549 0.94 HSP90AA1 (0.66) HSP90AA1TLR9NSD2G6PDCDK5
SCHEMBL4813305 0.92 HSP90AA1 (0.66) HSP90AA1TLR9NSD2G6PDCDK5
Water SCHEMBL185743 0.91 HSP90AA1 (0.64) HSP90AA1TLR9NSD2G6PDCDK5
SCHEMBL29499146 0.91 HSP90AA1 (0.64) HSP90AA1TLR9NSD2G6PDCDK5
Water SCHEMBL5921888 0.90 HSP90AA1 (0.63) HSP90AA1TLR9NSD2G6PDCDK5
SCHEMBL25506709 0.90 HSP90AA1 (0.62) HSP90AA1TLR9NSD2G6PDCDK5

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 60 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200347013-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2020-11-05 — — US claimed
US-10590071-B2 Process for the preparation of isosulfan blue APICORE US LLC (US) 2020-03-17 — — US claimed
US-10562847-B2 Method for preparation of isosulfan blue Beloteca Investment Fund 1, LLC (US) 2020-02-18 — — US claimed
US-10464888-B2 Process for the preparation of isosulfan blue APICORE US LLC (US) 2019-11-05 — — US claimed
US-20190225626-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-07-25 — — US claimed
US-20190177269-A1 Process for the preparation of Isosulfan Blue APICORE US LLC (US) 2019-06-13 — — US claimed
US-20190152903-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE Beloteca Investment Fund 1, LLC (US) 2019-05-23 — — US claimed
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2018-03-01 — — US claimed
WO-2018008040-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2018-01-11 — — WO claimed
WO-2017218764-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE BELOTECA, INC. (US) 2017-12-21 — — WO claimed
US-20160221936-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2016-08-04 — — US claimed
US-9353050-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2016-05-31 — — US claimed
US-8969616-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2015-03-03 — — US claimed
US-20130310600-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2013-11-21 — — US claimed
US-20120078007-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2012-03-29 — — US claimed
US-20100094044-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2010-04-15 — — US claimed
US-7662992-B2 Process for preparation of isosulfan blue APICORE, LLC (US) 2010-02-16 — — US claimed
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE APICORE, LLC (US) 2008-11-27 — — US claimed
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2008-11-13 — — US claimed
US-12595228-B2 Process for synthesizing triarylmethane sulfone compounds PROVEPHARM LIFE SOLUTIONS (FR) 2026-04-07 — — US disclosed
EP-4132905-B1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS PROVEPHARM LIFE SOLUTIONS (FR) 2024-05-15 — — EP disclosed
EP-4132906-B1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS PROVEPHARM LIFE SOLUTIONS (FR) 2024-05-15 — — EP disclosed
EP-4361127-A2 PROCESS FOR THE SYNTHESIS OF SULFONATED TRIARYLMETHANE COMPOUNDS Provepharm Life Solutions (FR) 2024-05-01 — — EP disclosed
US-20230348372-A1 PROCESS FOR SYNTHESIZING TRIARYLMETHANE SULFONE COMPOUNDS PROVEPHARM LIFE SOLUTIONS (FR) 2023-11-02 — — US disclosed
US-20230159444-A1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS PROVEPHARM LIFE SOLUTIONS (FR) 2023-05-25 — — US disclosed
US-20230159444-A1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS PROVEPHARM LIFE SOLUTIONS (FR) 2023-05-25 — — US disclosed
EP-4132905-A1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS Provepharm Life Solutions (FR) 2023-02-15 — — EP disclosed
EP-4132906-A1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS Provepharm Life Solutions (FR) 2023-02-15 — — EP disclosed
US-20200347013-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2020-11-05 — — US disclosed
US-10752580-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2020-08-25 — — US disclosed
US-10752580-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2020-08-25 — — US disclosed
US-10723745-B2 Isosulfan blue, its crystalline form and process for preparation thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2020-07-28 — — US disclosed
US-10723745-B2 Isosulfan blue, its crystalline form and process for preparation thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2020-07-28 — — US disclosed
US-10723745-B2 Isosulfan blue, its crystalline form and process for preparation thereof BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2020-07-28 — — US disclosed
US-10626086-B2 Process for the preparation of isosulfan blue APICORE US LLC (US) 2020-04-21 — — US disclosed
US-10562847-B2 Method for preparation of isosulfan blue Beloteca Investment Fund 1, LLC (US) 2020-02-18 — — US disclosed
US-10464888-B2 Process for the preparation of isosulfan blue APICORE US LLC (US) 2019-11-05 — — US disclosed
US-20190225626-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-07-25 — — US disclosed
US-20190225626-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-07-25 — — US disclosed
US-20190225626-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2019-07-25 — — US disclosed
US-20190218177-A1 Process for the preparation of Isosulfan Blue APICORE US LLC (US) 2019-07-18 — — US disclosed
US-20190177269-A1 Process for the preparation of Isosulfan Blue APICORE US LLC (US) 2019-06-13 — — US disclosed
US-20190152903-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE Beloteca Investment Fund 1, LLC (US) 2019-05-23 — — US disclosed
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2018-03-01 — — US disclosed
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2018-03-01 — — US disclosed
WO-2018008040-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF BIOPHORE INDIA PHARMACEUTICALS PVT. LTD. (IN) 2018-01-11 — — WO disclosed
WO-2017218764-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE BELOTECA, INC. (US) 2017-12-21 — — WO disclosed
WO-2017218764-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE BELOTECA, INC. (US) 2017-12-21 — — WO disclosed
WO-2017118882-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF ISOSULFAN BLUE DISHMAN PHARMACEUTICALS AND CHEMICALS LTD. (IN) 2017-07-13 — — WO disclosed
US-9353050-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2016-05-31 — — US disclosed
US-8969616-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2015-03-03 — — US disclosed
US-8969616-B2 Process for preparation of isosulfan blue APICORE US LLC (US) 2015-03-03 — — US disclosed
US-20130310600-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2013-11-21 — — US disclosed
US-20120078007-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2012-03-29 — — US disclosed
US-20100094044-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2010-04-15 — — US disclosed
US-7662992-B2 Process for preparation of isosulfan blue APICORE, LLC (US) 2010-02-16 — — US disclosed
US-7534911-B2 Process for the preparation of Isosulphan Blue INNOVASSYNTH TECHNOLOGIES (INDIA) LTD. (IN) 2009-05-19 — — US disclosed
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE APICORE, LLC (US) 2008-11-27 — — US disclosed
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE APICORE, LLC (US) 2008-11-27 — — US disclosed
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2008-11-13 — — US disclosed
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2008-11-13 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (21 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100094044-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS HSP90AA1 1667/4885TLR9 2190/4885NSD2 3766/4885
US-12595228-B2 Process for synthesizing triarylmethane sulfone compounds TST, SULT1E1, SULT1A1 HSP90AA1 3351/4885TLR9 3384/4885NSD2 1670/4885
US-20200347013-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST HSP90AA1 2236/4885TLR9 2359/4885NSD2 3826/4885
US-20190225626-A1 ISOSULFAN BLUE, ITS CRYSTALLINE FORM AND PROCESS FOR PREPARATION THEREOF SI, IK, RPS4Y1 HSP90AA1 1440/4885TLR9 4580/4885NSD2 745/4885
US-10752580-B2 Process for preparation of isosulfan blue SI, STS, MPST HSP90AA1 2236/4885TLR9 2359/4885NSD2 3826/4885
US-10464888-B2 Process for the preparation of isosulfan blue SI, STS, MPST HSP90AA1 1989/4885TLR9 2208/4885NSD2 3872/4885
US-20190218177-A1 Process for the preparation of Isosulfan Blue SI, STS, MPST HSP90AA1 1989/4885TLR9 2208/4885NSD2 3872/4885
US-10626086-B2 Process for the preparation of isosulfan blue SI, STS, MPST HSP90AA1 1989/4885TLR9 2208/4885NSD2 3872/4885
US-20120078007-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS HSP90AA1 1667/4885TLR9 2190/4885NSD2 3766/4885
US-20160221936-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST HSP90AA1 2236/4885TLR9 2359/4885NSD2 3826/4885
US-20190152903-A1 METHOD FOR PREPARATION OF ISOSULFAN BLUE TST, MB, SI HSP90AA1 2208/4885TLR9 3245/4885NSD2 2010/4885
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE SI, STS, MPST HSP90AA1 1506/4885TLR9 2350/4885NSD2 3601/4885
US-20130310600-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS HSP90AA1 1667/4885TLR9 2190/4885NSD2 3766/4885
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST HSP90AA1 2236/4885TLR9 2359/4885NSD2 3826/4885
US-10590071-B2 Process for the preparation of isosulfan blue SI, STS, MPST HSP90AA1 1989/4885TLR9 2208/4885NSD2 3872/4885
US-10562847-B2 Method for preparation of isosulfan blue TST, MB, SI HSP90AA1 2208/4885TLR9 3245/4885NSD2 2010/4885
US-10723745-B2 Isosulfan blue, its crystalline form and process for preparation thereof SI, IK, RPS4Y1 HSP90AA1 1440/4885TLR9 4580/4885NSD2 745/4885
US-20190177269-A1 Process for the preparation of Isosulfan Blue SI, STS, MPST HSP90AA1 1989/4885TLR9 2208/4885NSD2 3872/4885
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS HSP90AA1 1667/4885TLR9 2190/4885NSD2 3766/4885
US-20230348372-A1 PROCESS FOR SYNTHESIZING TRIARYLMETHANE SULFONE COMPOUNDS TST, SQOR, SDHA HSP90AA1 3349/4885TLR9 3576/4885NSD2 2467/4885
US-20230159444-A1 PROCESS FOR SYNTHESIZING SULFONATED TRIARYL METHANE COMPOUNDS SQOR, SULT1E1, TST HSP90AA1 2355/4885TLR9 1509/4885NSD2 1792/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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