SCHEMBL6581010

SCHEMBL6581010

CCCC(Cc1ccccc1COc1ccc(OCc2ccc3ccccc3n2)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 8/20 0.62
CYSLTR1 Q9Y271 8/20 0.62
GPBAR1 Q8TDU6 1/20 0.57
FFAR1 O14842 1/20 0.53
AKR1B1 P15121 1/20 0.53
ALOX5 P09917 6/20 0.52
PDE10A Q9Y233 2/20 0.52
HDAC6 Q9UBN7 1/20 0.52

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
SCHEMBL6582489 0.93 CYSLTR1 (0.61) CYSLTR2CYSLTR1GPBAR1ALOX5
SCHEMBL6089369 0.82 CYSLTR2 (0.57) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL8646511 0.81 CYSLTR2 (0.63) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL6584606 0.80 CYSLTR1 (0.51) CYSLTR2CYSLTR1GPBAR1ALOX5
SCHEMBL6089876 0.79 GPBAR1 (0.68) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL6091295 0.78 CYSLTR1 (0.65) CYSLTR2CYSLTR1GPBAR1
SCHEMBL6088287 0.78 CYSLTR2 (0.53) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL7454590 0.77 GPBAR1 (0.74) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL6588072 0.77 GPBAR1 (0.59) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1
SCHEMBL9018916 0.77 ALOX5 (0.67) CYSLTR2CYSLTR1GPBAR1FFAR1AKR1B1

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
EP-0784052-B1 Quinoline derivatives as antagonists of leukotriene d4, compositions containing the same and processes for their preparation AVENTIS HOLDINGS INC (US) 2004-09-01 EP disclosed
EP-0784052-A1 Quinoline derivatives as antagonists of leukotriene d4, compositions containing the same and processes for their preparation RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1997-07-16 EP disclosed
WO-1989012628-A1 QUINOLINE DERIVATIVES AS ANTAGONISTS OF LEUKOTRIENE D4 RORER INTERNATIONAL (OVERSEAS) INC. (US) 1989-12-28 WO disclosed
EP-0348155-A1 Quinoline derivatives as antagonists of leukotriene D4, compositions containing the same and processes for their preparation RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1989-12-27 EP disclosed