SCHEMBL7841396

SCHEMBL7841396

NS(=O)(=O)c1ccc(-c2nc(S(=O)(=O)c3cccc(F)c3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 19/20 0.54
PTGS1 P23219 11/20 0.54
MAP2K7 O14733 1/20 0.44
MAP2K4 P45985 1/20 0.44

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
SCHEMBL7841123 1.00 PTGS2 (0.54) PTGS2PTGS1MAP2K7MAP2K4
SCHEMBL7844087 0.91 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7841996 0.91 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7841570 0.90 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL7842021 0.90 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL7843460 0.90 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7842673 0.90 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL7844100 0.90 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7834434 0.90 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL7833848 0.89 PTGS2 (0.59) 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