SCHEMBL8664320

SCHEMBL8664320

CCCCN(CC(F)(F)F)C(=O)C1c2ccccc2-c2cccc(N3CCC(N4Cc5ccccc5C4=O)C3)c21

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 7/20 0.36
▸ SCN5A Q14524 7/20 0.36
▸ SCN9A Q15858 7/20 0.36
▸ C5AR1 P21730 8/20 0.36
▸ MTR Q99707 1/20 0.35
▸ KDM5A P29375 1/20 0.35
▸ AOC3 Q16853 1/20 0.35
▸ NPY1R P25929 1/20 0.34
▸ NPY5R Q15761 1/20 0.34
▸ MCHR1 Q99705 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
SCHEMBL8479245 0.95 SCN1A (0.39) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8664246 0.94 SCN1A (0.35) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8502228 0.94 SCN1A (0.33) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8666693 0.93 SCN1A (0.35) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8487923 0.90 SCN1A (0.38) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8479606 0.88 SCN1A (0.37) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8503698 0.88 SCN1A (0.33) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8666051 0.87 SCN1A (0.37) SCN1ASCN5ASCN9AC5AR1MTR
SCHEMBL8503790 0.87 SCN1A (0.32) SCN1ASCN5ASCN9AMTR
SCHEMBL8666036 0.85 SCN1A (0.37) SCN1ASCN5ASCN9AC5AR1MTR

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
US-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 — — US disclosed
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