SCHEMBL7653189

SCHEMBL7653189

[CH2]CCCCCc1ccc(CCC)c2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.41
MAPT P10636 3/20 0.38
CNR2 P34972 7/20 0.37
CNR1 P21554 1/20 0.36
CYP3A4 P08684 2/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 2/20 0.36
USP2 O75604 1/20 0.36
GLA P06280 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TYR P14679 2/20 0.36
MEN1 O00255 1/20 0.36
TP53 P04637 1/20 0.36
ALOX5 P09917 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL7654737 0.98 CNR2 (0.38) LIPGMAPTCNR2CNR1CYP3A4
SCHEMBL7653475 0.92 CNR2 (0.39) LIPGCNR2CNR1KDM4EALDH1A1
SCHEMBL7649388 0.86 LIPG (0.48) LIPGALOX5THRATHRB
SCHEMBL7655901 0.84 CNR2 (0.40) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7648157 0.84 LIPG (0.46) LIPGALOX5THRATHRB
SCHEMBL7650731 0.84 CYP1A2 (0.46) LIPGMAPTCNR2CYP3A4ALDH1A1
SCHEMBL11779245 0.82 LIPG (0.57) LIPGMAPTCNR2CYP3A4KDM4E
SCHEMBL30537736 0.82 LIPG (0.57) LIPGMAPTCNR2CYP3A4KDM4E
SCHEMBL30537733 0.82 KDM4E (0.46) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL798769 0.82 KDM4E (0.46) CNR2CNR1KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492364-B1 Triazolo and derivatives as chemokine inhibitors TORAY INDUSTRIES, INC. (JP) 2002-12-10 US disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 EP disclosed