SCHEMBL1379998

SCHEMBL1379998

CC(C)(C)OC(=O)N1CCCC1C(c1ccccc1)C(O)(c1cccnc1)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 10/20 0.47
KCNH2 Q12809 6/20 0.47
GPR119 Q8TDV5 2/20 0.42
UCHL1 P09936 2/20 0.40
LMNA P02545 1/20 0.38
KLK7 P49862 1/20 0.38

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
SCHEMBL15014675 0.91 KCNA5 (0.44) KCNA5KCNH2LMNA
SCHEMBL3889488 0.87 KCNA5 (0.52) KCNA5KCNH2LMNA
SCHEMBL3823590 0.87 KCNA5 (0.54) KCNA5KCNH2LMNA
SCHEMBL4143386 0.81 GPR119 (0.47) GPR119UCHL1
SCHEMBL3442475 0.78 GPR119 (0.47) GPR119UCHL1LMNA
SCHEMBL21713147 0.77 KLK7 (0.46) GPR119UCHL1LMNAKLK7
SCHEMBL20400353 0.77 KLK7 (0.46) GPR119UCHL1LMNAKLK7
SCHEMBL1843454 0.76 KLK7 (0.45) GPR119UCHL1LMNAKLK7
SCHEMBL13997813 0.76 KLK7 (0.45) GPR119UCHL1LMNAKLK7
SCHEMBL29997863 0.76 KLK7 (0.45) GPR119UCHL1LMNAKLK7

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 7 patents. 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
JP-4719744-B2 2011-07-06 JP claimed
EP-1776355-A4 POTASSIUM CHANNEL INHIBITORS MERCK & CO INC (US) 2009-08-12 EP claimed
EP-1776355-A2 POTASSIUM CHANNEL INHIBITORS Merck & Co., Inc. (US) 2007-04-25 EP claimed
WO-2006014877-A2 POTASSIUM CHANNEL INHIBITORS MERCK & CO., INC. (US) 2006-02-09 WO claimed
US-7569589-B2 Potassium channel inhibitors MERCK & CO., INC. (US) 2009-08-04 US disclosed
US-7569589-B2 Potassium channel inhibitors MERCK & CO., INC. (US) 2009-08-04 US disclosed