SCHEMBL15102401

SCHEMBL15102401

CC(C)Nc1nc(Nc2ccccc2)nc(-c2cccc(S(C)(=O)=O)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 Q9ULD8 8/20 0.58
▸ JAK2 O60674 1/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ CTSK P43235 1/20 0.49
▸ PTGS2 P35354 2/20 0.47
▸ SYK P43405 1/20 0.46
▸ IDH2 P48735 2/20 0.45
▸ POLB P06746 1/20 0.44
▸ IDH1 O75874 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42

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
SCHEMBL15102388 0.93 KCNH3 (0.55) KCNH3JAK2JAK3CA1CA2
SCHEMBL29763287 0.87 CA1 (0.60) KCNH3CA1CA2CA9CTSK
SCHEMBL15102261 0.87 CA1 (0.60) KCNH3CA1CA2CA9CTSK
SCHEMBL16392015 0.84 ABCG2 (0.57) JAK2JAK3PTGS2KDM4EMEN1
SCHEMBL29560743 0.83 KCNH3 (0.53) KCNH3CA1CA2CA9CTSK
SCHEMBL15102602 0.83 KCNH3 (0.53) KCNH3CA1CA2CA9CTSK
SCHEMBL15102555 0.82 IDH1 (0.69) SYKIDH2IDH1
SCHEMBL15102338 0.82 KCNH3 (0.81) KCNH3CA1CA2CA9CTSK
SCHEMBL19486673 0.82 KCNH3 (0.81) KCNH3CA1CA2CA9CTSK
SCHEMBL15102564 0.82 KCNH3 (0.52) KCNH3CA1CA2CA9CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230250078-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC (US) 2023-08-10 — — US disclosed
US-20230250078-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC (US) 2023-08-10 — — US disclosed
US-11505538-B1 Therapeutically active compounds and their methods of use SERVIER PHARMACEUTICALS LLC (US) 2022-11-22 — — US disclosed
EP-3984997-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE Les Laboratoires Servier SAS (FR) 2022-04-20 — — EP disclosed
US-10294215-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2019-05-21 — — US disclosed
EP-2800743-B1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2018-04-04 — — EP disclosed
US-20170298045-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-10-19 — — US disclosed
US-20170298045-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-10-19 — — US disclosed
US-9732062-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-08-15 — — US disclosed
US-9732062-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-08-15 — — US disclosed
US-9656999-B2 Therapeutically active compounds and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-05-23 — — US disclosed
US-20170044139-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-02-16 — — US disclosed
US-20170044139-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-02-16 — — US disclosed
US-9512107-B2 Therapeutically active compositions and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2016-12-06 — — US disclosed
US-9512107-B2 Therapeutically active compositions and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2016-12-06 — — US disclosed
US-20160318903-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2016-11-03 — — US disclosed
US-20160318903-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2016-11-03 — — US disclosed
US-20130190287-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2013-07-25 — — US disclosed
US-20130190287-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2013-07-25 — — US disclosed
WO-2013102431-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2013-07-11 — — WO 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 (7 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-20160318903-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE MCL1, TP53, MMP8 KCNH3 4664/4885JAK2 2233/4885JAK3 3820/4885
US-20230250078-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885
US-11505538-B1 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885
US-20170298045-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885
US-20170044139-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885
US-20130190287-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885
US-10294215-B2 Therapeutically active compounds and their methods of use MCL1, TP53, BRDT KCNH3 4722/4885JAK2 1396/4885JAK3 3804/4885

“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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