SCHEMBL9757088

SCHEMBL9757088

CCOC(=O)c1nc2ccc(OCc3cccc(OCc4ccc5ccccc5n4)c3)cc2o1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.58
CYSLTR1 Q9Y271 9/20 0.55
CYSLTR2 Q9NS75 6/20 0.55
GPBAR1 Q8TDU6 2/20 0.53
MAOB P27338 1/20 0.51

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
SCHEMBL9617594 0.94 CYSLTR1 (0.56) ALOX5CYSLTR1CYSLTR2GPBAR1MAOB
SCHEMBL9757095 0.92 CYSLTR1 (0.55) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757109 0.86 CYSLTR1 (0.54) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757243 0.86 CYSLTR1 (0.54) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9635690 0.83 ALOX5 (0.55) ALOX5CYSLTR1CYSLTR2GPBAR1MAOB
SCHEMBL9756954 0.82 CYSLTR1 (0.49) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757199 0.81 CYSLTR1 (0.48) ALOX5CYSLTR1CYSLTR2GPBAR1MAOB
SCHEMBL9757272 0.81 CYSLTR1 (0.60) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757212 0.79 GPBAR1 (0.60) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL6091574 0.79 ALOX5 (0.58) ALOX5CYSLTR1CYSLTR2GPBAR1

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