SCHEMBL5312294

SCHEMBL5312294

O=C(O)c1ccc(N2CCCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)C2=O)nn1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCD O00767 11/20 0.41
P2RX7 Q99572 1/20 0.39
PROKR1 Q8TCW9 3/20 0.37
DCTPP1 Q9H773 2/20 0.35
ENPP2 Q13822 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34

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
SCHEMBL5311048 0.86 SCD (0.49) SCDDCTPP1
SCHEMBL5313956 0.84 SCD (0.51) SCDDCTPP1
SCHEMBL5306113 0.83 SCD (0.46) SCDDCTPP1
SCHEMBL5308956 0.83 SCD (0.35) SCDDCTPP1
SCHEMBL5309844 0.80 SCD (0.49) SCDP2RX7PROKR1DCTPP1
SCHEMBL5309311 0.78 SCD (0.46) SCDDCTPP1
SCHEMBL5310722 0.78 SCD (0.37) SCDDCTPP1
SCHEMBL5306420 0.75 SCD (0.51) SCDDCTPP1
SCHEMBL5309746 0.73 SCD (0.68) SCDDCTPP1
SCHEMBL5309847 0.73 SCD (0.42) SCDP2RX7DCTPP1ENPP2

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