SCHEMBL7843511

SCHEMBL7843511

CS(=O)(=O)c1ccccc1-c1nc(C(=O)c2cc(F)cc(F)c2)sc1-c1ccc(F)cc1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 0.45
PTGS1 P23219 3/20 0.43
ALOX5 P09917 1/20 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
SCHEMBL7843246 0.93 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7841287 0.92 PTGS2 (0.44) PTGS2PTGS1ALOX5
SCHEMBL7842493 0.92 PTGS2 (0.45) PTGS2PTGS1ALOX5
SCHEMBL7845635 0.92 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7845397 0.91 PTGS2 (0.46) PTGS2PTGS1ALOX5
SCHEMBL7841025 0.89 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7841034 0.88 PTGS2 (0.45) PTGS2PTGS1ALOX5
SCHEMBL7844963 0.88 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7840854 0.87 PTGS2 (0.45) PTGS2PTGS1ALOX5
SCHEMBL7834265 0.87 PTGS2 (0.44) PTGS2PTGS1ALOX5

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 4 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 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