SCHEMBL7801692

SCHEMBL7801692

OC1c2ccccc2COc2ccc(OCc3ccc4ccccc4n3)cc21

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 4/20 0.57
PDE10A Q9Y233 1/20 0.51
CYSLTR1 Q9Y271 6/20 0.48
GPBAR1 Q8TDU6 5/20 0.48
CYSLTR2 Q9NS75 2/20 0.48
ALOX5AP P20292 1/20 0.48
ALOX5 P09917 1/20 0.46

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
SCHEMBL7806673 0.90 LTB4R (0.47) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2
SCHEMBL7801438 0.90 LTB4R (0.47) LTB4RPDE10ACYSLTR1CYSLTR2
SCHEMBL7806716 0.89 LTB4R (0.47) LTB4RPDE10ACYSLTR1GPBAR1ALOX5AP
SCHEMBL7813330 0.89 LTB4R (0.47) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2
SCHEMBL7808147 0.89 LTB4R (0.47) LTB4RPDE10ACYSLTR1CYSLTR2ALOX5AP
SCHEMBL7801813 0.87 LTB4R (0.47) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2
SCHEMBL7810770 0.87 LTB4R (0.46) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2
SCHEMBL7813383 0.85 LTB4R (0.43) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2
SCHEMBL7801372 0.85 LTB4R (0.43) LTB4RPDE10ACYSLTR1CYSLTR2ALOX5AP
SCHEMBL13765165 0.84 PDE10A (0.55) LTB4RPDE10ACYSLTR1GPBAR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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