Sugi Predict

Sugi Predict / Compounds / SCHEMBL867464

SCHEMBL867464

SCHEMBL867464

O=Cc1cc(S(=O)(=O)O)ccc1S(=O)(=O)O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.41
▸ HSD17B10 Q99714 4/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ LMNA P02545 1/20 0.40
▸ TDP1 Q9NUW8 3/20 0.39
▸ TSHR P16473 3/20 0.39
▸ NT5E P21589 2/20 0.39
▸ HPGD P15428 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TIMP3 P35625 1/20 0.36
▸ SENP3 Q9H4L4 2/20 0.35
▸ SENP2 Q9HC62 2/20 0.35

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
SCHEMBL30023628 1.00 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL19718140 0.98 ALDH1A1 (0.40) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL867590 0.98 ALDH1A1 (0.40) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL29396279 0.84 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL225048 0.84 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL31696807 0.83 ALDH1A1 (0.44) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL14003821 0.83 ERN1 (0.34) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
Water SCHEMBL4381911 0.82 ALDH1A1 (0.41) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL3719523 0.82 TDP1 (0.52) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6
SCHEMBL4882745 0.82 ALDH1A1 (0.40) ALDH1A1HSD17B10CYP2C9CYP2C19CASP6

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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005355-A Compression-resistant dry-mixed mortar and preparation method thereof 高碑店市绿荣装饰材料有限公司 2024-05-10 — — CN claimed
CN-115172606-A Perovskite solar cell based on homojunction interface crosslinking and preparation method thereof 华北电力大学 2022-10-11 — — CN claimed
US-20200347013-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2020-11-05 — — US claimed
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE US LLC (US) 2018-03-01 — — US 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
CN-101456831-A Method for preparing 2,5-disulfonic benzaldehyde BEIJING CHARNA CHEMICALS LTD (CN) 2009-06-17 — — CN claimed
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE APICORE, LLC (US) 2008-11-27 — — US claimed
WO-2008140564-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2008-11-20 — — WO claimed
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE APICORE, LLC (US) 2008-11-13 — — US claimed
CN-118005355-A Compression-resistant dry-mixed mortar and preparation method thereof 高碑店市绿荣装饰材料有限公司 2024-05-10 — — CN disclosed
CN-118005355-A Compression-resistant dry-mixed mortar and preparation method thereof 高碑店市绿荣装饰材料有限公司 2024-05-10 — — CN disclosed
US-4096154-A FORMING A SULFONIUM SALT BY REACTION OF A HALOGEN AS ESTER WITH AN ORGANIC SULFIDE CIBA-GEIGY CORPORATION (US) 1978-06-20 — — US disclosed
US-4016203-A Process for the manufacture of compounds containing vinyl groups CIBA-GEIGY CORPORATION (US) 1977-04-05 — — 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 (8 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 ALDH1A1 89/4885HSD17B10 1272/4885CYP2C9 34/4885
US-20200347013-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST ALDH1A1 77/4885HSD17B10 1152/4885CYP2C9 36/4885
US-20120078007-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS ALDH1A1 89/4885HSD17B10 1272/4885CYP2C9 34/4885
US-20160221936-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST ALDH1A1 77/4885HSD17B10 1152/4885CYP2C9 36/4885
US-20080293963-A1 PROCESS FOR PREPARATION ISOSULFAN BLUE SI, STS, MPST ALDH1A1 70/4885HSD17B10 1188/4885CYP2C9 28/4885
US-20130310600-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS ALDH1A1 89/4885HSD17B10 1272/4885CYP2C9 34/4885
US-20180057454-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, STS, MPST ALDH1A1 77/4885HSD17B10 1152/4885CYP2C9 36/4885
US-20080281127-A1 PROCESS FOR PREPARATION OF ISOSULFAN BLUE SI, MPST, STS ALDH1A1 89/4885HSD17B10 1272/4885CYP2C9 34/4885

“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.