SCHEMBL6974845

SCHEMBL6974845

CS(=O)(=O)c1ccc(-c2oc3ccccc3c(=O)c2-c2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 8/20 0.72
PLA2G2A P14555 1/20 0.61
PLA2G4A P47712 1/20 0.61
MAPK14 Q16539 2/20 0.55
PTGS1 P23219 1/20 0.54
ABCG2 Q9UNQ0 1/20 0.52
CA1 P00915 2/20 0.51
CA2 P00918 2/20 0.51
DDR2 Q16832 1/20 0.51
KDM4E B2RXH2 1/20 0.51
MEN1 O00255 1/20 0.51
CA12 O43570 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
ABCB1 P08183 1/20 0.51
CYP3A4 P08684 1/20 0.51
CALM1 P0DP23 1/20 0.51
AR P10275 1/20 0.51
PKM P14618 1/20 0.51
ALOX15 P16050 1/20 0.51

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
SCHEMBL6977093 0.92 PTGS2 (0.85) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6973940 0.92 PTGS2 (0.69) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6978875 0.91 PTGS2 (0.67) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6979358 0.91 PTGS2 (0.67) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6970224 0.91 PTGS2 (0.67) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6973317 0.90 PTGS2 (0.63) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL3245012 0.90 PTGS2 (0.82) PTGS2PLA2G2APLA2G4APTGS1
SCHEMBL6979278 0.90 MAPK14 (0.71) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6976272 0.89 PTGS2 (0.65) PTGS2PLA2G2APLA2G4AMAPK14PTGS1
SCHEMBL6978497 0.89 PTGS2 (0.65) PTGS2PLA2G2APLA2G4AMAPK14PTGS1

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