SCHEMBL7801623

SCHEMBL7801623

N#Cc1cccc2c1COc1ccc(OCc3ccc4ccc(Cl)cc4n3)cc1C2SCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 7/20 0.37
CYSLTR2 Q9NS75 5/20 0.37
ALOX5AP P20292 2/20 0.36
GPBAR1 Q8TDU6 1/20 0.35

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
SCHEMBL7810406 0.90 CYSLTR1 (0.36) CYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL7806793 0.89 CYSLTR1 (0.39) CYSLTR1CYSLTR2ALOX5AP
SCHEMBL7802326 0.88 TBXA2R (0.44)
SCHEMBL7813563 0.85 LTB4R (0.41) CYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL7809961 0.84 CYSLTR1 (0.35) CYSLTR1CYSLTR2
SCHEMBL7806750 0.84 TBXA2R (0.42) CYSLTR1CYSLTR2
SCHEMBL7806627 0.84 ALOX5AP (0.42) CYSLTR1CYSLTR2ALOX5AP
SCHEMBL7806846 0.84 CYSLTR2 (0.44) CYSLTR1CYSLTR2
SCHEMBL7809811 0.83 TBXA2R (0.44) CYSLTR1CYSLTR2
SCHEMBL7801612 0.83 CYSLTR1 (0.40) CYSLTR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0685478-B1 QUINOLINE DERIVATIVES UBE INDUSTRIES (JP) 2001-10-24 EP claimed
EP-0685478-A1 QUINOLINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 1995-12-06 EP claimed
EP-0685478-B1 QUINOLINE DERIVATIVES UBE INDUSTRIES (JP) 2001-10-24 EP disclosed
US-5591752-A LEUKOTRIENE ANTAGONIST, ANTIALLERGEN, ANTIINFLAMMATORY AGENT, DIBENZ(B,E)OXEPINE UBE INDUSTRIES, LTD. (JP) 1997-01-07 US disclosed
EP-0685478-A1 QUINOLINE DERIVATIVE UBE INDUSTRIES, LTD. (JP) 1995-12-06 EP disclosed