SCHEMBL7846916

SCHEMBL7846916

NS(=O)(=O)c1ccc(-c2nc(COc3cccc(Cl)c3)sc2-c2ccc(F)cc2)cc1

nearest known ligand 0.84

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 14/20 0.84
PTGS1 P23219 7/20 0.84
PPARD Q03181 6/20 0.45

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
SCHEMBL7844584 1.00 PTGS2 (0.84) PTGS2PTGS1PPARD
SCHEMBL7833376 0.91 PTGS2 (0.75) PTGS2PTGS1PPARD
SCHEMBL7839927 0.91 PTGS2 (1.00) PTGS2PTGS1PPARD
SCHEMBL7834121 0.91 PTGS2 (0.75) PTGS2PTGS1PPARD
SCHEMBL7842175 0.91 PTGS2 (1.00) PTGS2PTGS1PPARD
SCHEMBL7842012 0.90 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL6442569 0.90 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL7845512 0.89 PTGS2 (0.71) PTGS2PTGS1PPARD
SCHEMBL7843493 0.89 PTGS2 (0.71) PTGS2PTGS1PPARD
SCHEMBL7842564 0.88 PTGS2 (0.83) 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 3 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
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