SCHEMBL7981871

SCHEMBL7981871

Cc1cc(-c2ccc(F)c(Cl)c2)c(-c2ccc(S(C)(=O)=O)cc2)[nH]1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 20/20 0.65
PTGS1 P23219 3/20 0.54

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
SCHEMBL7989398 0.88 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL7983368 0.87 PTGS2 (0.66) PTGS2PTGS1
SCHEMBL7983046 0.85 PTGS2 (0.60) PTGS2PTGS1
SCHEMBL7985927 0.83 PTGS2 (0.58) PTGS2PTGS1
SCHEMBL7985849 0.82 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL7986169 0.82 PTGS2 (0.62) PTGS2PTGS1
SCHEMBL7981809 0.82 PTGS2 (0.77) PTGS2PTGS1
SCHEMBL7990459 0.81 PTGS2 (0.60) PTGS2
SCHEMBL7982199 0.81 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL7986597 0.81 PTGS2 (0.52) PTGS2

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
US-6294568-B1 ANTIINFLAMMATORY AGENTS AND ANTITUMOR AGENTS CONTAINING THE COMPOUNDS AS THE ACTIVE INGREDIENTS AND COX2 ENZYME INHIBITORS NISSIN FOOD PRODUCTS CO., LTD. (JP) 2001-09-25 US disclosed
EP-1048649-A1 5-ARYLPYRROLE DERIVATIVES NISSIN FOOD PRODUCTS CO., LTD. (JP) 2000-11-02 EP disclosed