SCHEMBL8770622

SCHEMBL8770622

CCc1cc(-c2cc(F)c(F)cc2-c2ccc(S(N)(=O)=O)cc2)ccc1N(C)C

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.71
PTGS1 P23219 15/20 0.71

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
SCHEMBL6728807 0.87 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL6732663 0.87 PTGS2 (0.78) PTGS2PTGS1
SCHEMBL6725940 0.84 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6724758 0.84 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6725422 0.83 PTGS2 (1.00) PTGS2PTGS1
SCHEMBL6721646 0.82 PTGS2 (0.72) PTGS2PTGS1
SCHEMBL6725761 0.81 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL6725904 0.81 PTGS2 (0.70) PTGS2PTGS1
SCHEMBL6725851 0.81 PTGS2 (0.74) PTGS2PTGS1
SCHEMBL6723820 0.81 PTGS2 (0.81) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0794942-A1 SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-09-17 EP claimed
WO-1996016934-A1 SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-06-06 WO claimed