SCHEMBL6979230

SCHEMBL6979230

NS(=O)(=O)c1ccc(-c2oc3cc(F)ccc3c(=O)c2-c2ccc(F)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.65
PTGS1 P23219 6/20 0.65
MAPK14 Q16539 2/20 0.50
MAOA P21397 1/20 0.48
MAOB P27338 1/20 0.48
TDO2 P48775 1/20 0.45
MAP2K7 O14733 1/20 0.45
MAP2K4 P45985 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
SCHEMBL6982972 0.90 PTGS2 (0.57) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6976446 0.90 PTGS2 (0.69) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6979302 0.89 PTGS2 (0.53) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6981239 0.88 PTGS1 (0.52) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6976602 0.87 PTGS2 (0.57) PTGS2PTGS1MAOB
SCHEMBL6981004 0.87 PTGS2 (0.85) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6972864 0.87 PTGS2 (0.59) PTGS2PTGS1MAPK14TDO2
SCHEMBL6978743 0.86 PTGS2 (0.50) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6981010 0.85 PTGS2 (0.52) PTGS2PTGS1MAPK14MAOAMAOB
SCHEMBL6980615 0.84 PTGS2 (0.68) PTGS2PTGS1MAPK14

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 10 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
CN-1323301-A Diarylbenzopyran derivatives as cyclooxygenase-2 inhibitors PACIFIC CORP (KR) 2001-11-21 CN 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
CN-1323301-A Diarylbenzopyran derivatives as cyclooxygenase-2 inhibitors PACIFIC CORP (KR) 2001-11-21 CN 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