SCHEMBL992660

SCHEMBL992660

O=C(NCCC1CC1)c1ccc(N2CCN(c3cccc(C(F)(F)F)c3)CC2)nn1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SCD O00767 13/20 0.65

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
SCHEMBL15190226 0.84 CHRM4 (0.51) SCD
SCHEMBL994925 0.82 SCD (0.67) SCD
SCHEMBL1599828 0.81 SCD (0.84) SCD
SCHEMBL1600785 0.81 SCD (0.84) SCD
SCHEMBL993579 0.80 NPSR1 (0.56)
SCHEMBL1380106 0.78 SCD (1.00) SCD
SCHEMBL5596966 0.78 SCD (0.72) SCD
SCHEMBL992405 0.78 SCD (0.70) SCD
SCHEMBL993242 0.78 SCD (0.64) SCD
SCHEMBL1379527 0.78 SCD (0.77) SCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8026360-B2 Substituted pyridazines as stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC. (CA) 2011-09-27 US claimed
EP-2269610-A2 Heterocyclic derivatives and their use as stearoyl-coa desaturase inhibitors Xenon Pharmaceuticals Inc. (CA) 2011-01-05 EP claimed
US-8026360-B2 Substituted pyridazines as stearoyl-CoA desaturase inhibitors XENON PHARMACEUTICALS INC. (CA) 2011-09-27 US disclosed
EP-2269610-A2 Heterocyclic derivatives and their use as stearoyl-coa desaturase inhibitors Xenon Pharmaceuticals Inc. (CA) 2011-01-05 EP disclosed