SCHEMBL3925872

SCHEMBL3925872

COc1ccc(C2(N)CNC(=O)N2CCc2ccc(OC(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.43
POLB P06746 1/20 0.39
GSK3A P49840 2/20 0.39
GSK3B P49841 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
DAO P14920 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KCNJ1 P48048 1/20 0.37
KCNH2 Q12809 1/20 0.37
RIPK3 Q9Y572 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
BACE1 P56817 4/20 0.36
REN P00797 1/20 0.36
CTSD P07339 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36

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
SCHEMBL3925802 0.91 KCNA5 (0.50) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3925563 0.90 KCNA5 (0.44) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3914514 0.89 KCNA5 (0.44) KCNA5POLBKCNH2
SCHEMBL3917852 0.87 KCNA5 (0.57) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3920282 0.85 KCNA5 (0.43) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3915740 0.84 KCNA5 (0.44) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3916295 0.83 KCNA5 (0.46) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3915932 0.82 KCNA5 (0.60) KCNA5GSK3AGSK3BSIGMAR1DAO
Hydrochloric Acid SCHEMBL3918248 0.81 KCNA5 (0.59) KCNA5GSK3AGSK3BSIGMAR1DAO
SCHEMBL3925128 0.80 KCNA5 (0.41) KCNA5POLBGSK3AGSK3BKCNH2

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-2035392-A1 IMIDAZOLE KV1. 5 POTASSIUM CHANNEL INHIBITORS Wyeth a Corporation of the State of Delaware (US) 2009-03-18 EP disclosed
WO-2007149874-A1 IMIDAZOLIDINONE KV1.5 POTASSIUM CHANNEL INHIBITORS WYETH (US) 2007-12-27 WO disclosed