SCHEMBL5306259

SCHEMBL5306259

O=C(Nc1cccnn1)c1ccc(N2CCCN(C(=O)c3cc(F)cc(F)c3C(F)(F)F)C2=O)nn1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 7/20 0.38
FAAH O00519 8/20 0.36
KMT2A Q03164 1/20 0.33
STING1 Q86WV6 1/20 0.33

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
SCHEMBL5312567 0.88 FAAH (0.37) SCDFAAH
SCHEMBL5306362 0.85 SCD (0.50) SCD
SCHEMBL5312649 0.84 SCD (0.43) SCDFAAH
SCHEMBL5307473 0.78 SCD (0.41) SCDSTING1
SCHEMBL5308956 0.77 SCD (0.35) SCDSTING1
SCHEMBL5314381 0.76 SCD (0.51) SCD
SCHEMBL5312568 0.75 FAAH (0.37) FAAHKMT2A
SCHEMBL5309398 0.74 SCD (0.49) SCD
SCHEMBL5309311 0.73 SCD (0.46) SCD
SCHEMBL5306274 0.73 FAAH (0.42) SCDFAAH

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