SCHEMBL212661

SCHEMBL212661

O=C(N[C@@H]1CCCC[C@H]1O)c1nc(-c2cccc(Cl)c2)c(OCC2CC2)nc1C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 18/20 0.61
CNR2 P34972 7/20 0.55

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
SCHEMBL213558 0.92 CNR1 (0.55) CNR1CNR2
SCHEMBL214048 0.90 CNR1 (0.68) CNR1CNR2
SCHEMBL212405 0.89 CNR1 (0.61) CNR1CNR2
SCHEMBL14856768 0.88 CNR1 (0.56) CNR1CNR2
SCHEMBL215181 0.87 CNR1 (0.56) CNR1CNR2
SCHEMBL212640 0.86 CNR1 (0.51) CNR1CNR2
SCHEMBL212276 0.84 TRPV1 (0.46) CNR1CNR2
SCHEMBL1018009 0.83 MDM2 (0.44) CNR1CNR2
SCHEMBL211995 0.81 CNR1 (0.56) CNR1CNR2
SCHEMBL214387 0.81 CNR1 (0.61) CNR1CNR2

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
US-8088920-B2 3-trifluoromethyl-pyrazine-2-carboxylic acid amide derivatives as HDL-cholesterol raising agents HOFFMANN-LA ROCHE INC. (US) 2012-01-03 US claimed
EP-2271632-A1 3-TRIFLUOROMETHYL-PYRAZINE-2-CARBOXYLIC ACID AMIDE DERIVATIVES AS HDL-CHOLESTEROL RAISING AGENTS F. Hoffmann-La Roche AG (CH) 2011-01-12 EP claimed
US-8088920-B2 3-trifluoromethyl-pyrazine-2-carboxylic acid amide derivatives as HDL-cholesterol raising agents HOFFMANN-LA ROCHE INC. (US) 2012-01-03 US disclosed