SCHEMBL9757061

SCHEMBL9757061

CCCN1c2cc(OCc3cccc(OCc4ccc5ccccc5n4)c3)ccc2OC1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.53
CYSLTR1 Q9Y271 11/20 0.52
CYSLTR2 Q9NS75 8/20 0.52
GPBAR1 Q8TDU6 4/20 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
SCHEMBL9756957 0.79 ALOX5 (0.46) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757091 0.78 CYSLTR1 (0.56) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757154 0.78 CYSLTR1 (0.51) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757161 0.78 CYSLTR1 (0.54) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9761166 0.76 CYSLTR1 (0.56) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9757158 0.76 CYSLTR1 (0.56) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL7711072 0.75 GPBAR1 (0.80) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL7716691 0.74 CYSLTR1 (0.88) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL9022221 0.74 CYSLTR1 (0.67) ALOX5CYSLTR1CYSLTR2GPBAR1
SCHEMBL6088484 0.73 CYSLTR1 (0.69) 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