SCHEMBL9528256

SCHEMBL9528256

COc1cc(C(=O)O)ccc1Cc1c(Cl)n(C)c2ccc(CC3CCN(C)C3=O)cc12

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 6/20 0.40
LTB4R Q15722 2/20 0.40
CYSLTR2 Q9NS75 6/20 0.39
CYSLTR1 Q9Y271 6/20 0.39
PPARG P37231 1/20 0.38

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
SCHEMBL9528873 0.93 TP53 (0.37) CYSLTR2CYSLTR1PPARG
SCHEMBL9528720 0.84 CYSLTR1 (0.52) PLA2G4ACYSLTR2CYSLTR1PPARG
SCHEMBL9526756 0.84 PLA2G4A (0.48) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL9531909 0.84 CYSLTR1 (0.51) PLA2G4ACYSLTR2CYSLTR1PPARG
SCHEMBL9526681 0.81 CYSLTR2 (0.60) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL9527319 0.77 CYSLTR2 (0.60) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL9526857 0.77 CYSLTR1 (0.44) PLA2G4ACYSLTR2CYSLTR1PPARG
SCHEMBL9490186 0.75 PLA2G4A (0.41) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL9526827 0.75 CYSLTR2 (0.50) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL9527465 0.74 CYSLTR2 (0.53) CYSLTR2CYSLTR1

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