SCHEMBL28064012

SCHEMBL28064012

O=C(Nc1cc[nH]c(=O)c1)c1ccccc1-c1ccc(F)cc1

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 16/20 0.67
SCN10A Q9Y5Y9 16/20 0.67
HTT P42858 1/20 0.57
TP53 P04637 1/20 0.54
MAPT P10636 1/20 0.50

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
SCHEMBL28063993 0.82 SCN8A (0.69) SCN8ASCN10A
SCHEMBL28064011 0.82 SCN8A (0.69) SCN8ASCN10A
SCHEMBL17045005 0.81 SCN8A (0.65) SCN8ASCN10AMAPT
SCHEMBL28063990 0.81 SCN8A (0.67) SCN8ASCN10AHTTTP53MAPT
SCHEMBL28827905 0.81 SCN8A (0.70) SCN8ASCN10A
SCHEMBL15561698 0.81 SCN8A (1.00) SCN8ASCN10A
SCHEMBL28827910 0.80 SCN8A (0.74) SCN8ASCN10A
SCHEMBL15901791 0.78 SCN8A (0.65) SCN8ASCN10A
SCHEMBL29970845 0.77 CHRNB2 (0.78) HTTTP53MAPT
SCHEMBL29201497 0.77 CHRNB2 (0.78) HTTTP53MAPT

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
CN-105473554-A Fused piperidine amides as modulators of ion channels VERTEX PHARMA 2016-04-06 CN disclosed