SCHEMBL9756983

SCHEMBL9756983

C(=C/c1ccc2nc(-c3nnn[nH]3)oc2c1)\c1cccc(OCc2ccc3ccccc3n2)c1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 9/20 0.49
CYSLTR1 Q9Y271 9/20 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
SCHEMBL9757276 1.00 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9757235 0.93 CYSLTR2 (0.49) CYSLTR2CYSLTR1
SCHEMBL9757114 0.93 CYSLTR2 (0.46) CYSLTR2CYSLTR1
SCHEMBL9757125 0.88 CYSLTR1 (0.51) CYSLTR2CYSLTR1
SCHEMBL9757016 0.87 CYSLTR1 (0.52) CYSLTR2CYSLTR1
SCHEMBL9757288 0.86 CYSLTR2 (0.46) CYSLTR2CYSLTR1
SCHEMBL9757219 0.85 CYSLTR1 (0.52) CYSLTR2CYSLTR1
SCHEMBL9821257 0.85 CYSLTR1 (0.52) CYSLTR2CYSLTR1
SCHEMBL9034212 0.85 CYSLTR1 (0.52) CYSLTR2CYSLTR1
SCHEMBL9756990 0.84 CYSLTR1 (0.49) 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 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