SCHEMBL9757078

SCHEMBL9757078

Cc1c(C(=O)O)sc2ccc(COc3cccc(C=Cc4ccc5ccc(Cl)cc5n4)c3)cc12

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 16/20 0.53
CYSLTR2 Q9NS75 11/20 0.53

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
SCHEMBL9757150 0.89 CYSLTR1 (0.43) CYSLTR1CYSLTR2
SCHEMBL9757649 0.82 CYSLTR1 (0.44) CYSLTR1CYSLTR2
SCHEMBL9757151 0.82 NR4A2 (0.43) CYSLTR1CYSLTR2
SCHEMBL9757226 0.81 EDNRA (0.48) CYSLTR1CYSLTR2
SCHEMBL9757227 0.81 EDNRA (0.48) CYSLTR1CYSLTR2
SCHEMBL9757716 0.79 ALOX5AP (0.48) CYSLTR1CYSLTR2
SCHEMBL9757147 0.75 EDNRA (0.42)
SCHEMBL9757209 0.75 CYSLTR1 (0.43) CYSLTR1CYSLTR2
SCHEMBL10402152 0.72 CYSLTR1 (0.65) CYSLTR1CYSLTR2
SCHEMBL10402153 0.72 CYSLTR1 (0.65) CYSLTR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991019475-A2 QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1991-12-26 WO claimed
US-5041453-A Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-08-20 US claimed
WO-1991019475-A2 QUINOLINYL-BENZOHETEROBICYCLIC DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D¿4? RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1991-12-26 WO disclosed
US-5041453-A Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-08-20 US disclosed