SCHEMBL7813383

SCHEMBL7813383

OC1c2ccccc2COc2ccc(OCc3ccc4cccc(F)c4n3)cc21

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 4/20 0.43
CYSLTR1 Q9Y271 4/20 0.41
CYSLTR2 Q9NS75 2/20 0.41
ALOX5AP P20292 2/20 0.40
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GPBAR1 Q8TDU6 3/20 0.35
PDE10A Q9Y233 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
SCHEMBL7801692 0.85 LTB4R (0.57) LTB4RCYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL7810463 0.84 TBXA2R (0.45) CYSLTR1CYSLTR2
SCHEMBL7801438 0.83 LTB4R (0.47) LTB4RCYSLTR1CYSLTR2PDE10A
SCHEMBL7808147 0.83 LTB4R (0.47) LTB4RCYSLTR1CYSLTR2ALOX5APPDE10A
SCHEMBL7801372 0.82 LTB4R (0.43) LTB4RCYSLTR1CYSLTR2ALOX5APKMT2A
SCHEMBL7810454 0.80 LTB4R (0.41) LTB4RCYSLTR1CYSLTR2ALOX5APPDE10A
SCHEMBL7806673 0.80 LTB4R (0.47) LTB4RCYSLTR1CYSLTR2ALOX5APKMT2A
SCHEMBL7810770 0.79 LTB4R (0.46) LTB4RCYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL7813330 0.79 LTB4R (0.47) LTB4RCYSLTR1CYSLTR2ALOX5APGPBAR1
SCHEMBL7806716 0.79 LTB4R (0.47) LTB4RCYSLTR1ALOX5APKMT2AMEN1

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