SCHEMBL7716747

SCHEMBL7716747

Cc1cc(C(=O)O)ccc1OCc1cccc(OCc2ccc3ccccc3n2)c1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.67
GPBAR1 Q8TDU6 4/20 0.67
CYSLTR2 Q9NS75 6/20 0.58
ALOX5 P09917 1/20 0.58

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
SCHEMBL7717046 0.92 CYSLTR1 (0.67) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL7455455 0.92 CYSLTR1 (0.67) CYSLTR1GPBAR1ALOX5
SCHEMBL7458688 0.92 CYSLTR1 (0.67) CYSLTR1GPBAR1ALOX5
SCHEMBL7717180 0.89 CYSLTR1 (0.66) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL7009377 0.89 CYSLTR1 (0.66) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL7711072 0.87 GPBAR1 (0.80) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL7716691 0.87 CYSLTR1 (0.88) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL10533300 0.86 CYSLTR1 (0.57) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL6091338 0.86 CYSLTR1 (0.61) CYSLTR1GPBAR1CYSLTR2ALOX5
SCHEMBL7714576 0.86 CYSLTR1 (0.64) CYSLTR1GPBAR1CYSLTR2ALOX5

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
US-6376512-B1 FOR TREATING PHYSIOLOGICAL CONDITION IN PATIENT WHEREIN SAID CONDITION IS ASSOCIATED WITH A PHYSIOLOGICALLY DETRIMENTAL LEVELS OF INSULIN, GLUCOSE, FREE FATTY ACIDS, OR TRIGLYCERIDES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-23 US disclosed
EP-0315399-B1 Quinoline derivatives, their use in the treatment of hypersensitive ailments and a pharmaceutical composition containing the same RHONE POULENC RORER INT (US) 1996-01-10 EP disclosed
US-5059610-A QUINOLINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF LEUKOTRIENE D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-10-22 US disclosed
US-4920132-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 US disclosed