SCHEMBL6981004

SCHEMBL6981004

NS(=O)(=O)c1ccc(-c2oc3ccccc3c(=O)c2-c2ccc(F)cc2)cc1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 10/20 0.85
PTGS1 P23219 5/20 0.85
MAPK14 Q16539 6/20 0.67
PLA2G2A P14555 1/20 0.52
PLA2G4A P47712 1/20 0.52
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48

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
SCHEMBL6981356 0.92 PTGS2 (0.72) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6968474 0.91 PTGS2 (0.72) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6980058 0.89 PTGS2 (0.69) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6974322 0.89 PTGS2 (0.67) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6974513 0.89 PTGS2 (0.67) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6977376 0.88 PTGS2 (0.67) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6976315 0.88 MAPK14 (0.71) PTGS2PTGS1MAPK14PLA2G2APLA2G4A
SCHEMBL6974186 0.88 PTGS2 (0.81) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6979230 0.87 PTGS2 (0.65) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6976446 0.87 PTGS2 (0.69) PTGS2PTGS1MAPK14MAOAMAOB

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
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-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-13 EP claimed
WO-2000010993-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-03-02 WO 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