SCHEMBL5207917

SCHEMBL5207917

CCCCCCC=CCc1[c]cccc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.42
SOAT2 O75908 1/20 0.41
SOAT1 P35610 1/20 0.41
FAAH O00519 4/20 0.40
EPHX2 P34913 3/20 0.40
KCNH2 Q12809 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
MGLL Q99685 1/20 0.37

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
SCHEMBL5207708 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5209886 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5206574 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5204826 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5207398 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5207240 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5207401 1.00 CYP2D6 (0.42) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5206588 0.98 CYP2D6 (0.40) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL4057587 0.93 CYP2D6 (0.35) CYP2D6SOAT2SOAT1FAAHEPHX2
SCHEMBL5207722 0.87 SOAT2 (0.41) SOAT2SOAT1FAAHEPHX2TRPV1

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-0980867-B1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES (JP) 2007-08-08 EP disclosed
US-6100292-A Ketone derivatives and their medical applications TORAY INDUSTRIES, INC. (JP) 2000-08-08 US disclosed
EP-0980867-A1 KETONE DERIVATIVES AND MEDICINAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2000-02-23 EP disclosed