SCHEMBL6972219

SCHEMBL6972219

CS(=O)(=O)c1ccc(-c2oc3ccccc3c(=O)c2-c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 14/20 0.66
PTGS1 P23219 4/20 0.61
MAPK14 Q16539 2/20 0.49
PLA2G2A P14555 1/20 0.48
PLA2G4A P47712 1/20 0.48
ADORA3 P0DMS8 1/20 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
SCHEMBL6981445 0.90 PTGS2 (0.63) PTGS2PTGS1MAPK14
SCHEMBL6977227 0.90 PTGS2 (0.63) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6971292 0.88 PTGS2 (0.65) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6981487 0.88 PTGS2 (0.62) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6977368 0.87 PTGS2 (0.65) PTGS2PTGS1
SCHEMBL6976262 0.87 PTGS2 (0.59) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6979358 0.87 PTGS2 (0.67) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6974845 0.85 PTGS2 (0.72) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6976350 0.85 PTGS2 (0.61) PTGS2PTGS1MAPK14ADORA3
SCHEMBL6978497 0.85 PTGS2 (0.65) PTGS2PTGS1MAPK14PLA2G2APLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1105384-B1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-03-26 EP claimed
US-6340694-B1 Diarylbenzopyran derivatives as cyclooxygenase-2 inhibitors PACIFIC CORPORATION (KR) 2002-01-22 US claimed
EP-1105384-B1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-03-26 EP disclosed
US-6340694-B1 Diarylbenzopyran derivatives as cyclooxygenase-2 inhibitors PACIFIC CORPORATION (KR) 2002-01-22 US disclosed
EP-1105384-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-13 EP disclosed
WO-2000010993-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-03-02 WO disclosed