SCHEMBL7841585

SCHEMBL7841585

CS(=O)(=O)c1ccccc1-c1sc(S(=O)(=O)c2cccc(Cl)c2)nc1-c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 16/20 0.48
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGS1 P23219 2/20 0.42
ALOX5 P09917 1/20 0.42
KDM1A O60341 1/20 0.41
L3MBTL1 Q9Y468 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
SCHEMBL7840176 0.92 PTGS2 (0.48) PTGS2RAB9AKMT2APTGS1ALOX5
SCHEMBL7845249 0.92 PTGS2 (0.50) PTGS2PTGS1ALOX5
SCHEMBL7846444 0.91 PTGS2 (0.46) PTGS2PTGS1ALOX5
SCHEMBL7833627 0.89 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7840262 0.89 PTGS2 (0.54) PTGS2RAB9APTGS1ALOX5
SCHEMBL7846033 0.89 PTGS2 (0.51) PTGS2PTGS1ALOX5
SCHEMBL7846490 0.88 PTGS2 (0.53) PTGS2PTGS1ALOX5
SCHEMBL7840994 0.87 PTGS2 (0.47) PTGS2PTGS1ALOX5
SCHEMBL7840175 0.86 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7841584 0.86 PTGS2 (0.61) PTGS2PTGS1

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