SCHEMBL7455455

SCHEMBL7455455

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

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 6/20 0.67
GPBAR1 Q8TDU6 3/20 0.67
MRGPRX4 Q96LA9 7/20 0.61
ALOX5 P09917 1/20 0.56

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
SCHEMBL7458688 1.00 CYSLTR1 (0.67) CYSLTR1GPBAR1MRGPRX4ALOX5
SCHEMBL7716747 0.92 CYSLTR1 (0.67) CYSLTR1GPBAR1ALOX5
SCHEMBL10532737 0.89 CYSLTR1 (0.54) CYSLTR1GPBAR1MRGPRX4
SCHEMBL7452285 0.88 CYSLTR1 (0.77) CYSLTR1GPBAR1MRGPRX4ALOX5
SCHEMBL7010090 0.87 CYSLTR1 (0.84) CYSLTR1GPBAR1MRGPRX4ALOX5
SCHEMBL7717046 0.86 CYSLTR1 (0.67) CYSLTR1GPBAR1ALOX5
SCHEMBL7718823 0.85 CYSLTR1 (0.69) CYSLTR1GPBAR1MRGPRX4ALOX5
SCHEMBL7716691 0.85 CYSLTR1 (0.88) CYSLTR1GPBAR1MRGPRX4ALOX5
SCHEMBL7714576 0.84 CYSLTR1 (0.64) CYSLTR1GPBAR1ALOX5
SCHEMBL7454982 0.83 CYSLTR1 (0.69) CYSLTR1GPBAR1MRGPRX4ALOX5

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1030665-A4 THERAPEUTIC USES OF QUINOLINE DERIVATIVES AVENTIS PHARM PROD INC (US) 2002-11-27 EP disclosed
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-1030665-A1 THERAPEUTIC USES OF QUINOLINE DERIVATIVES Aventis Pharmaceuticals Products Inc. (US) 2000-08-30 EP disclosed
WO-1999020275-A1 THERAPEUTIC USES OF QUINOLINE DERIVATIVES AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-04-29 WO 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