SCHEMBL7215320

SCHEMBL7215320

COc1ccc(-c2cccn2-c2ccc(S(N)(=O)=O)cc2)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.63
PTGS1 P23219 15/20 0.63

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
SCHEMBL7216358 0.93 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7211955 0.89 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7210640 0.86 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL7215260 0.86 PTGS2 (0.57) PTGS2PTGS1
SCHEMBL2466714 0.85 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL7216225 0.82 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL7211992 0.82 PTGS2 (0.68) PTGS2PTGS1
SCHEMBL7216255 0.81 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL7216641 0.81 PTGS2 (0.56) PTGS2PTGS1
SCHEMBL8502462 0.81 PTGS2 (0.51) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1369415-A1 Substituted pyrrolyl compounds for the treatment of inflammation G.D. SEARLE & CO. (US) 2003-12-10 EP disclosed
EP-0946507-A1 SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1999-10-06 EP disclosed
WO-1998025896-A1 SUBSTITUTED PYRROLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1998-06-18 WO disclosed