SCHEMBL7845155

SCHEMBL7845155

CS(=O)(=O)c1ccc(-c2nc(S(=O)(=O)Cc3ccc(Cl)cc3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.71
PTGS1 P23219 2/20 0.57

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
SCHEMBL7843752 1.00 PTGS2 (0.71) PTGS2PTGS1
SCHEMBL7846581 0.94 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL7845331 0.94 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL7845888 0.91 PTGS2 (0.63) PTGS2PTGS1
SCHEMBL7843964 0.91 PTGS2 (0.63) PTGS2PTGS1
SCHEMBL7832206 0.90 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7847323 0.90 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7842731 0.89 PTGS2 (0.67) PTGS2PTGS1
SCHEMBL7842996 0.89 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL7844001 0.89 PTGS2 (0.67) 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