SCHEMBL15005751

SCHEMBL15005751

CN(C(=O)O)c1cccc(C(c2ccc(F)cc2)C(c2cccnc2F)c2cccnc2F)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.38
KCNE1 P15382 1/20 0.38
KCNQ1 P51787 1/20 0.38
KCND3 Q9UK17 1/20 0.38
GRM1 Q13255 2/20 0.35
NAPRT Q6XQN6 1/20 0.33
RCE1 Q9Y256 1/20 0.32
LMNA P02545 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTGDR2 Q9Y5Y4 3/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL15005662 0.91 KCNA5 (0.48) KCNA5KCNE1KCNQ1KCND3GRM1
SCHEMBL1379550 0.77 KCNE1 (0.45) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL15005753 0.76 KCNE1 (0.39) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL1379052 0.76 KCNE1 (0.44) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL1382054 0.74 KCNA5 (0.69) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL5944333 0.73 KCNA5 (0.45) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL15005704 0.72 KCNA5 (0.56) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL15005713 0.71 KCNE1 (0.39) KCNA5KCNE1KCNQ1KCND3KMT2A
SCHEMBL1380402 0.70 KCNA5 (0.56) KCNA5KCNE1KCNQ1KCND3LMNA
SCHEMBL1380949 0.68 KCNA5 (0.60) KCNA5KCNE1KCNQ1KCND3L3MBTL1

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
EP-1776355-B1 POTASSIUM CHANNEL INHIBITORS MERCK SHARP & DOHME (US) 2013-06-12 EP claimed