SCHEMBL9757031

SCHEMBL9757031

COC(=O)c1sc2ccc(OCc3cccc(OCc4ccc5ccccc5n4)c3)cc2c1C

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.58
ALOX5 P09917 1/20 0.57
GPBAR1 Q8TDU6 2/20 0.53
PDE10A Q9Y233 1/20 0.52
CYSLTR2 Q9NS75 6/20 0.50
ALOX5AP P20292 1/20 0.49

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
SCHEMBL9757233 0.93 CYSLTR1 (0.55) CYSLTR1ALOX5GPBAR1PDE10AALOX5AP
SCHEMBL9757076 0.91 ALOX5 (0.59) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9757124 0.90 ALOX5 (0.58) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9757054 0.84 PDE10A (0.58) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9760846 0.83 ALOX5 (0.49) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9757119 0.83 PDE10A (0.54) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9757208 0.83 CYSLTR1 (0.61) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL9757033 0.83 PDE10A (0.54) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2
SCHEMBL6090654 0.79 CYSLTR1 (0.63) CYSLTR1ALOX5GPBAR1ALOX5AP
SCHEMBL9757036 0.78 CYSLTR1 (0.53) CYSLTR1ALOX5GPBAR1PDE10ACYSLTR2

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 2 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 disclosed
US-5041453-A Quinolinyl-benzoheterobicyclic derivatives as antagonists of leukotriene D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-08-20 US disclosed