SCHEMBL5597018

SCHEMBL5597018

NC(=O)C(CCc1ccccc1)c1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 15/20 0.63
DCTPP1 Q9H773 2/20 0.63

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
SCHEMBL1377929 0.88 SCD (0.57) SCDDCTPP1
SCHEMBL5596566 0.86 SCD (0.54) SCDDCTPP1
SCHEMBL5270946 0.84 SCD (0.56) SCDDCTPP1
SCHEMBL1376823 0.83 SCD (0.60) SCDDCTPP1
SCHEMBL1378420 0.81 SCD (0.57) SCDDCTPP1
SCHEMBL727991 0.79 SCD (0.67) SCDDCTPP1
SCHEMBL726265 0.79 SCD (0.67) SCDDCTPP1
SCHEMBL5596764 0.79 SCD (0.56) SCDDCTPP1
SCHEMBL27654491 0.79 SCD (0.56) SCDDCTPP1
SCHEMBL28797007 0.79 SCD (0.57) SCDDCTPP1

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-1846035-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2007-10-24 EP claimed
WO-2006086445-A2 COMBINATION THERAPY XENON PHARMACEUTICALS INC. (CA) 2006-08-17 WO claimed