SCHEMBL9527588

SCHEMBL9527588

CCCn1cc(Cc2ccc(C(=O)OC)cc2OC)c2cc(C(O)C3CCCN(C)C3=O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.53
CYSLTR1 Q9Y271 8/20 0.53
PLA2G4A P47712 2/20 0.43
EPHX2 P34913 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL9528153 0.95 CYSLTR2 (0.52) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9877877 0.93 CYSLTR2 (0.59) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9528110 0.90 CYSLTR2 (0.52) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9526810 0.90 CYSLTR2 (0.51) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9527890 0.89 CYSLTR2 (0.51) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9527925 0.86 CYSLTR1 (0.46) CYSLTR2CYSLTR1PLA2G4AEPHX2PPARG
SCHEMBL9526601 0.85 CYSLTR2 (0.50) CYSLTR2CYSLTR1PLA2G4A
SCHEMBL9527741 0.84 CYSLTR2 (0.54) CYSLTR2CYSLTR1
SCHEMBL9527769 0.83 CYSLTR1 (0.44) CYSLTR2CYSLTR1PLA2G4AEPHX2PPARG
SCHEMBL9527757 0.82 CYSLTR2 (0.52) CYSLTR2CYSLTR1PLA2G4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337767-B1 CYCLIC AMIDES ICI AMERICAS INC. (US) 1993-01-13 EP disclosed
US-5047402-A Leukotriene Antagonists ICI AMERICAS INC. (US) 1991-09-10 US disclosed
EP-0337767-A1 Cyclic amides ICI AMERICAS INC. (US) 1989-10-18 EP disclosed