SCHEMBL7843434

SCHEMBL7843434

CS(=O)(=O)c1ccccc1-c1nc(COc2cc(F)cc(F)c2)sc1-c1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 15/20 0.52
PTGS1 P23219 3/20 0.52
PPARD Q03181 4/20 0.41
ALOX5 P09917 1/20 0.40

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
SCHEMBL7843555 0.93 PTGS2 (0.51) PTGS2PTGS1PPARDALOX5
SCHEMBL7845379 0.92 PTGS2 (0.48) PTGS2PTGS1PPARD
SCHEMBL7843072 0.92 PTGS2 (0.52) PTGS2PTGS1PPARDALOX5
SCHEMBL7840138 0.92 PTGS2 (0.53) PTGS2PTGS1PPARDALOX5
SCHEMBL7842600 0.91 PTGS2 (0.65) PTGS2PTGS1PPARDALOX5
SCHEMBL7840172 0.89 PTGS2 (0.48) PTGS2PTGS1PPARD
SCHEMBL7832707 0.88 PTGS2 (0.49) PTGS2PTGS1PPARDALOX5
SCHEMBL7844586 0.88 PTGS2 (0.53) PTGS2PTGS1PPARD
SCHEMBL7843380 0.88 PTGS2 (0.47) PTGS2PTGS1PPARD
SCHEMBL7842015 0.88 PTGS2 (0.55) PTGS2PTGS1PPARD

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