SCHEMBL8503622

SCHEMBL8503622

CCCCN(CC(F)(F)F)C(=O)C1C(C)=C(N2CC(N3Cc4ccccc4C3=O)C2)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SCN1A P35498 9/20 0.34
▸ SCN5A Q14524 9/20 0.34
▸ SCN9A Q15858 9/20 0.34
▸ GAA P10253 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MTR Q99707 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM5A P29375 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MCHR1 Q99705 1/20 0.31

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
SCHEMBL8666051 0.94 SCN1A (0.37) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8484683 0.92 SCN1A (0.40) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8502228 0.86 SCN1A (0.33) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8503019 0.86 SCN1A (0.34) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8664320 0.82 SCN1A (0.36) SCN1ASCN5ASCN9AMTRKDM5A
SCHEMBL8666036 0.82 SCN1A (0.37) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8479245 0.80 SCN1A (0.39) SCN1ASCN5ASCN9AMTRMEN1
SCHEMBL8503698 0.80 SCN1A (0.33) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8480404 0.80 SCN1A (0.39) SCN1ASCN5ASCN9AGAANPSR1
SCHEMBL8503790 0.79 SCN1A (0.32) SCN1ASCN5ASCN9AGAANPSR1

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-5885983-A ANTICHOLESTEROL AGENTS, ANTILIPOLYTIC AGENTS, ANTILIPEMIC AGENTS FOR TREATING HYPERLIPEMIA, ATHEROSCLEROSIS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-23 — — US disclosed
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