SCHEMBL9527741

SCHEMBL9527741

CCCn1cc(Cc2ccc(C(=O)OC)cc2OC)c2cc(CC3CCCN(C)C3=O)ccc21

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.54
CYSLTR1 Q9Y271 8/20 0.54

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
SCHEMBL9527465 0.95 CYSLTR2 (0.53) CYSLTR2CYSLTR1
SCHEMBL9527319 0.93 CYSLTR2 (0.60) CYSLTR2CYSLTR1
SCHEMBL9527273 0.90 CYSLTR2 (0.52) CYSLTR2CYSLTR1
SCHEMBL9527211 0.89 CYSLTR2 (0.52) CYSLTR2CYSLTR1
SCHEMBL9526681 0.88 CYSLTR2 (0.60) CYSLTR2CYSLTR1
SCHEMBL9526857 0.86 CYSLTR1 (0.44) CYSLTR2CYSLTR1
SCHEMBL9526909 0.85 PLA2G4A (0.57) CYSLTR2CYSLTR1
SCHEMBL9527588 0.84 CYSLTR2 (0.53) CYSLTR2CYSLTR1
SCHEMBL9528115 0.83 CYSLTR2 (0.52) CYSLTR2CYSLTR1
SCHEMBL10531323 0.83 CYSLTR2 (0.44) 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