SCHEMBL8992092

SCHEMBL8992092

Cc1cc(C#N)cc(C)c1OCCCc1cccnn1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 3/20 0.39
VNN1 O95497 1/20 0.39
GRM5 P41594 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
BRD4 O60885 1/20 0.34
KCNH2 Q12809 2/20 0.32
GRIN1 Q05586 3/20 0.32
GRIN2B Q13224 3/20 0.32
EGLN2 Q96KS0 1/20 0.32
HRH4 Q9H3N8 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
SCHEMBL8663366 0.84 SCN8A (0.47) SCN8AGRM5
SCHEMBL8824480 0.82 SCN8A (0.38) SCN8AGRM5KCNH2EGLN2
SCHEMBL8824433 0.82 SCN8A (0.38) SCN8AKCNH2
SCHEMBL8824523 0.80 SCN8A (0.37) SCN8AGRM5KCNH2EGLN2
SCHEMBL8824506 0.80 SCN8A (0.37) SCN8AKCNH2
SCHEMBL8665185 0.79 SCN8A (0.43) SCN8A
SCHEMBL8992101 0.79 VNN1 (0.34) VNN1CTDSP1
SCHEMBL8923501 0.77 SCN8A (0.49) SCN8AVNN1
SCHEMBL8922786 0.76 SCN8A (0.42) SCN8AGRM5
SCHEMBL8824421 0.76 CTDSP1 (0.36) SCN8AVNN1CTDSP1

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-5514679-A TREATMENT OF PICORNAVIRUS INFECTIONS STERLING WINTHROP INC. (US) 1996-05-07 US disclosed