SCHEMBL5309646

SCHEMBL5309646

O=C(NCCC1CC1)c1ccc(N2C=CCN(C(=O)c3ccccc3C(F)(F)F)C2)nc1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.55
DCTPP1 Q9H773 1/20 0.41

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
SCHEMBL5306427 0.95 SCD (0.55) SCDDCTPP1
SCHEMBL5312248 0.94 SCD (0.56) SCDDCTPP1
SCHEMBL5312057 0.92 SCD (0.52) SCDDCTPP1
SCHEMBL5311996 0.90 SCD (0.58) SCDDCTPP1
SCHEMBL5310962 0.88 SCD (0.57) SCDDCTPP1
SCHEMBL5312492 0.88 EGLN1 (0.42) SCD
SCHEMBL5308879 0.88 SCD (0.56) SCDDCTPP1
SCHEMBL5307496 0.88 SCD (0.50) SCD
SCHEMBL5310977 0.88 SCD (0.56) SCDDCTPP1
SCHEMBL5308955 0.87 SCD (0.56) 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 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