SCHEMBL5310015

SCHEMBL5310015

O=C(Nc1cccnn1)c1ccc(N2CCCN(C(=O)c3ccccc3C(F)(F)F)C2)nc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 10/20 0.51
FASN P49327 1/20 0.40
GBA1 P04062 1/20 0.40
DCTPP1 Q9H773 1/20 0.40

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
SCHEMBL5309112 0.91 SCD (0.53) SCDFASNGBA1
SCHEMBL5309719 0.86 SCD (0.60) SCDDCTPP1
SCHEMBL5306274 0.85 FAAH (0.42) SCDFASN
SCHEMBL5315058 0.85 SCD (0.51) SCD
SCHEMBL5307319 0.85 SCD (0.59) SCD
SCHEMBL5306879 0.84 SCD (0.59) SCDGBA1
SCHEMBL5309407 0.84 SCD (0.53) SCD
SCHEMBL5309747 0.83 SCD (0.43) SCD
SCHEMBL5310018 0.83 SCD (0.45) SCDDCTPP1
SCHEMBL5307494 0.82 SCD (0.57) SCDGBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007046867-A2 PIPERIDINE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2007-04-26 WO disclosed