SCHEMBL3429809

SCHEMBL3429809

OC(CNc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FAAH O00519 14/20 0.62
TRPV3 Q8NET8 5/20 0.54
CYP2D6 P10635 1/20 0.50

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
SCHEMBL3407765 0.88 FAAH (0.66) FAAHCYP2D6
SCHEMBL12538857 0.82 TRPV3 (0.67) FAAHTRPV3
SCHEMBL3408600 0.81 FAAH (0.62) FAAHTRPV3
SCHEMBL13663433 0.81 FAAH (0.62) FAAHTRPV3
SCHEMBL14292066 0.80 AURKA (0.55) FAAHCYP2D6
SCHEMBL4779880 0.78 FAAH (0.49) FAAHCYP2D6
Trifluoroacetic Acid SCHEMBL4303325 0.77 FAAH (0.57) FAAHTRPV3
SCHEMBL4298846 0.77 FAAH (1.00) FAAH
SCHEMBL4303442 0.77 FAAH (1.00) FAAH
SCHEMBL3409393 0.76 FAAH (0.49) FAAHCYP2D6

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
EP-2254415-A1 ARYL-HYDROXYETHYLAMINO-PYRIMIDINES AND TRIAZINES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE Janssen Pharmaceutica, N.V. (BE) 2010-12-01 EP claimed
WO-2009105220-A1 ARYL-HYDROXYETHYLAMINO-PYRIMIDINES AND TRIAZINES AS MODULATORS OF FATTY ACID AMIDE HYDROLASE JANSSEN PHARMACEUTICA N.V. (BE) 2009-08-27 WO claimed