SCHEMBL14435382

SCHEMBL14435382

OCNc1cccc(N(c2ccc(F)cc2)C(c2cccnc2)c2cccnc2)n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.39
KCNE1 P15382 1/20 0.39
KCNQ1 P51787 1/20 0.39
KCND3 Q9UK17 1/20 0.39
POLB P06746 1/20 0.38
PTGER2 P43116 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
EPHX2 P34913 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
SCN9A Q15858 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLC6A3 Q01959 1/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 2/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL14435381 0.90 SMN1; SMN2 (0.38) KCNA5PTGER2SMN1; SMN2SLC6A3
SCHEMBL4456765 0.83 POLB (0.42) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL4469178 0.83 POLB (0.41) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL14435380 0.82 ROCK2 (0.36) KCNA5POLBL3MBTL1ALDH1A1KMT2A
SCHEMBL13971462 0.81 KCNA5 (0.38) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL4458292 0.81 POLB (0.42) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL4457249 0.81 KCNA5 (0.61) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL4470641 0.79 POLB (0.37) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL4458360 0.79 POLB (0.37) KCNA5KCNE1KCNQ1KCND3POLB
SCHEMBL13971459 0.78 CYP2C9 (0.39) KCNA5KCNE1KCNQ1KCND3POLB

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-2007089679-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2007-08-09 WO disclosed