SCHEMBL7876672

SCHEMBL7876672

CCc1ccc(-n2nc(Cl)cc2-c2ccc(S(C)(=O)=O)cc2)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 14/20 0.50
ALOX5 P09917 2/20 0.48
PTGS1 P23219 3/20 0.47
CYP2C9 P11712 1/20 0.47
AOC3 Q16853 1/20 0.43

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
SCHEMBL7878975 0.93 ALOX5 (0.51) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL28746692 0.91 PTGS2 (0.51) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL7879006 0.89 PTGS2 (0.52) PTGS2ALOX5PTGS1CYP2C9
SCHEMBL7874491 0.85 PTGS2 (0.46) PTGS2ALOX5PTGS1CYP2C9
SCHEMBL7867763 0.85 PTGS2 (0.57) PTGS2ALOX5PTGS1CYP2C9
SCHEMBL7867753 0.85 ALOX5 (0.53) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL27556744 0.84 PTGS2 (0.51) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL7867762 0.83 PTGS2 (0.48) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL7867865 0.83 ALOX5 (0.53) PTGS2ALOX5PTGS1CYP2C9AOC3
SCHEMBL7867587 0.82 PTGS2 (0.55) PTGS2ALOX5PTGS1CYP2C9

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6316485-B1 INHIBITS ACTIVITY OF CYCLOOXYGENASE-2; FOR THERAPY AND PROPHYLAXIS OF INFLAMMATION, THROMBOSIS, RHEUMATOID ARTHRITIS, ALZHEIMER'S DISEASE; AS ANALGESIC FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-13 US claimed
CN-1271347-A 1, 5-diphenylpyrazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-10-25 CN claimed
EP-1017678-A1 1,5-DIPHENYLPYRAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-12 EP claimed
WO-1999015505-A1 1,5-DIPHENYLPYRAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 WO claimed
US-6316485-B1 INHIBITS ACTIVITY OF CYCLOOXYGENASE-2; FOR THERAPY AND PROPHYLAXIS OF INFLAMMATION, THROMBOSIS, RHEUMATOID ARTHRITIS, ALZHEIMER'S DISEASE; AS ANALGESIC FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-11-13 US disclosed
CN-1271347-A 1, 5-diphenylpyrazole derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2000-10-25 CN disclosed
EP-1017678-A1 1,5-DIPHENYLPYRAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-12 EP disclosed
WO-1999015505-A1 1,5-DIPHENYLPYRAZOLE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-04-01 WO disclosed