SCHEMBL5306362

SCHEMBL5306362

O=C(Nc1cccnn1)c1ccc(N2CCCN(C(=O)c3ccccc3C(F)(F)F)C2=O)nn1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 14/20 0.50
DCTPP1 Q9H773 2/20 0.44

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
SCHEMBL5314381 0.91 SCD (0.51) SCDDCTPP1
SCHEMBL5309747 0.87 SCD (0.43) SCD
SCHEMBL5306420 0.85 SCD (0.51) SCDDCTPP1
SCHEMBL5306259 0.85 SCD (0.38) SCD
SCHEMBL5311048 0.83 SCD (0.49) SCDDCTPP1
SCHEMBL5308995 0.82 SCD (0.55) SCDDCTPP1
SCHEMBL5309538 0.82 SCD (0.51) SCDDCTPP1
SCHEMBL5309719 0.82 SCD (0.60) SCDDCTPP1
SCHEMBL1600481 0.81 SCD (0.75) SCDDCTPP1
SCHEMBL5309746 0.81 SCD (0.68) 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