SCHEMBL3941165

SCHEMBL3941165

NC(=O)C1c2ccccc2C(=O)N1CCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 17/20 0.58
KCNH2 Q12809 14/20 0.58
SCN5A Q14524 12/20 0.58
KCNQ2 O43526 1/20 0.44
KCNA5 P22460 1/20 0.44
SCN2A Q99250 1/20 0.44
CHRM5 P08912 1/20 0.43
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42

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
SCHEMBL3755957 0.84 SCN9A (0.61) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL3756567 0.83 SCN9A (0.76) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL3756103 0.80 SCN9A (0.62) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL13568403 0.74 SCN9A (1.00) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL3888988 0.73 SCN9A (0.58) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL3750835 0.73 MDM2 (0.57) SCN9AKCNH2SCN5AKCNA5
SCHEMBL3750814 0.73 SCN9A (0.66) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL3950452 0.71 SCN9A (0.67) SCN9AKCNH2SCN5AKCNQ2KCNA5
SCHEMBL7957008 0.71 ADRA1D (0.62) CHRM5ADRA1DADRA1AADRA1B
SCHEMBL3753489 0.71 SCN9A (0.67) SCN9AKCNH2SCN5AKCNQ2KCNA5

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049484-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS AstraZeneca AB (SE) 2009-04-22 EP disclosed
WO-2008008022-A1 ISOINDOLINE DERIVATIVES FOR THE TREATMENT OF ARRHYTHMIAS ASTRAZENECA AB (SE) 2008-01-17 WO disclosed