SCHEMBL20170695

SCHEMBL20170695

CC(C)(C)S(=O)(=O)c1cc2c(Nc3ccc4scnc4c3)ncnc2cc1OCCOP(O)O

nearest known ligand 0.83

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 18/20 0.83
GAK O14976 2/20 0.83
NOD2 Q9HC29 1/20 0.83
RIPK3 Q9Y572 6/20 0.47
RIPK1 Q13546 1/20 0.44

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
SCHEMBL14697655 0.91 RIPK2 (1.00) RIPK2GAKNOD2RIPK3
SCHEMBL29508237 0.91 RIPK2 (1.00) RIPK2GAKNOD2RIPK3
SCHEMBL14706943 0.91 RIPK2 (0.84) RIPK2GAKNOD2RIPK3
SCHEMBL14706920 0.91 RIPK2 (0.87) RIPK2GAKNOD2RIPK3RIPK1
SCHEMBL14698021 0.90 RIPK2 (0.82) RIPK2GAKNOD2RIPK3RIPK1
SCHEMBL14706917 0.90 RIPK2 (0.92) RIPK2GAKNOD2RIPK3RIPK1
SCHEMBL14697945 0.89 RIPK2 (0.84) RIPK2GAKNOD2RIPK3RIPK1
SCHEMBL25771943 0.89 RIPK2 (0.84) RIPK2GAKNOD2RIPK3RIPK1
SCHEMBL14706913 0.89 RIPK2 (0.84) RIPK2GAKNOD2RIPK3
SCHEMBL31500671 0.89 RIPK2 (1.00) RIPK2GAKNOD2RIPK3RIPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3323819-B1 COMBINATIONS OF RIP2 KINASE INHIBITOR PRODRUG 2-((4-(BENZO[D]THIAZOL-5-YLAMINO)-6-(TERT. -BUTYLSULFONYL)QUINAZOLIN-7-YL)OXY)ETHYL DIHYDROGEN PHOSPHATE WITH OTHER THERAPEUTIC AGENTS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-02-26 EP disclosed
EP-3323819-A1 PRODRUGS OF AMINO QUINAZOLINE KINASE INHIBITOR GlaxoSmithKline Intellectual Property Development Limited (GB) 2018-05-23 EP disclosed