SCHEMBL7844922

SCHEMBL7844922

CS(=O)(=O)c1ccccc1-c1sc(-c2ccc(Cl)cc2)nc1-c1ccc(F)cc1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.68
PTGS1 P23219 2/20 0.52
APEX1 P27695 1/20 0.50
ALOX5 P09917 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL7844167 0.92 PTGS2 (0.70) PTGS2PTGS1ALOX5
SCHEMBL7845090 0.89 PTGS2 (0.59) PTGS2PTGS1APEX1ALOX5
SCHEMBL7833474 0.89 PTGS2 (0.76) PTGS2PTGS1ALOX5
SCHEMBL7841919 0.89 PTGS2 (0.68) PTGS2PTGS1ALOX5
SCHEMBL7833476 0.87 PTGS2 (0.71) PTGS2PTGS1ALOX5
SCHEMBL7843228 0.86 PTGS2 (0.56) PTGS2PTGS1ALOX5
SCHEMBL7845047 0.86 PTGS2 (0.66) PTGS2PTGS1APEX1KDM4EALDH1A1
SCHEMBL7840262 0.85 PTGS2 (0.54) PTGS2PTGS1ALOX5KDM4EALDH1A1
SCHEMBL7843755 0.84 PTGS2 (0.49) PTGS2PTGS1ALOX5KDM4EALDH1A1
SCHEMBL7842525 0.84 PTGS2 (0.48) PTGS2PTGS1ALOX5KDM4EALDH1A1

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