SCHEMBL7653475

SCHEMBL7653475

[CH2]CCCc1ccc(CCC)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 8/20 0.39
CNR1 P21554 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
SLC22A12 Q96S37 3/20 0.36
LIPG Q9Y5X9 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
SCHEMBL7654737 0.94 CNR2 (0.38) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7653189 0.92 LIPG (0.41) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7655901 0.88 CNR2 (0.40) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7648927 0.85 LIPG (0.42) LIPG
SCHEMBL798769 0.85 KDM4E (0.46) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL30537733 0.85 KDM4E (0.46) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7654487 0.83 CNR2 (0.40) CNR2CNR1KDM4EALDH1A1GAA
SCHEMBL7654607 0.82 CYP1A2 (0.50) CNR2ALDH1A1
SCHEMBL30537734 0.81 CNR2 (0.48) CNR2LIPG
SCHEMBL8823285 0.81 CNR2 (0.48) CNR2LIPG

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