SCHEMBL21389922

SCHEMBL21389922

CCOC1CC(OCC(=O)NC23CC(NC(=O)c4ccc5cc(C(F)(F)F)ccc5n4)(C2)C3)C1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ATF4 P18848 4/20 0.53
▸ SCN9A Q15858 16/20 0.44
▸ SCN10A Q9Y5Y9 3/20 0.43
▸ SCN7A Q01118 2/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ SCN5A Q14524 2/20 0.41

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
SCHEMBL23294698 1.00 ATF4 (0.53) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL23333261 1.00 ATF4 (0.53) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390147 0.91 ATF4 (0.63) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL23294737 0.91 ATF4 (0.63) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390070 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390137 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL23294722 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390073 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL21390152 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2
SCHEMBL25962344 0.91 ATF4 (0.54) ATF4SCN9ASCN10ASCN7AKCNH2

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-2019183589-A1 MODULATORS OF EUKARYOTIC INITIATION FACTOR 2 DENALI THERAPEUTICS INC. (US) 2019-09-26 — — WO disclosed
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