SCHEMBL7841916

SCHEMBL7841916

CS(=O)(=O)c1ccc(-c2sc(-c3ccncc3)nc2-c2ccc(F)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 18/20 1.00
MAPK14 Q16539 1/20 0.68
PTGS1 P23219 2/20 0.62

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
SCHEMBL6508524 1.00 PTGS2 (1.00) PTGS2MAPK14PTGS1
SCHEMBL7832424 0.89 PTGS2 (1.00) PTGS2MAPK14PTGS1
SCHEMBL7844433 0.89 PTGS2 (0.80) PTGS2MAPK14
SCHEMBL7840831 0.88 PTGS2 (0.78) PTGS2MAPK14PTGS1
SCHEMBL7846438 0.88 PTGS2 (0.78) PTGS2MAPK14PTGS1
SCHEMBL6503233 0.88 PTGS2 (0.78) PTGS2MAPK14PTGS1
SCHEMBL7844918 0.88 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL7843526 0.86 PTGS2 (0.78) PTGS2MAPK14PTGS1
SCHEMBL7833473 0.86 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6503358 0.86 PTGS2 (0.78) PTGS2MAPK14PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP claimed
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP claimed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO claimed
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed