SCHEMBL5315103

SCHEMBL5315103

CCCCCCNC(=O)c1ccc(N2C=CCN(C(=O)c3ccccc3C(F)(F)F)C2=O)nc1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCD O00767 12/20 0.51
MLYCD O95822 1/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
MAPK14 Q16539 1/20 0.38
SMYD3 Q9H7B4 1/20 0.38
NAAA Q02083 1/20 0.38

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
SCHEMBL5315085 0.99 SCD (0.51) SCDMLYCDHDAC3HDAC1MAPK14
SCHEMBL5309158 0.97 SCD (0.52) SCDSMYD3
SCHEMBL5309661 0.94 SCD (0.53) SCD
SCHEMBL5309835 0.90 SCD (0.51) SCD
SCHEMBL5307184 0.90 SCD (0.51) SCDHDAC3HDAC1MAPK14
SCHEMBL5309062 0.89 SCD (0.51) SCDMAPK14
SCHEMBL5309118 0.87 SCD (0.51) SCD
SCHEMBL5306699 0.86 SCD (0.41) SCDMAPK14
SCHEMBL5307539 0.86 SCD (0.47) SCD
SCHEMBL5314479 0.86 EGLN1 (0.39) HDAC3HDAC1MAPK14NAAA

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