SCHEMBL4131059

SCHEMBL4131059

COC(=O)NC1(c2ccc(C(C)(C)C)cc2)CNC(=O)N1CCc1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.44
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
EPHX2 P34913 1/20 0.41
RAB9A P51151 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KCNA5 P22460 2/20 0.41
ALDH1A1 P00352 4/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
MAPK1 P28482 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.37
MMP1 P03956 1/20 0.37
MMP9 P14780 1/20 0.37

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
SCHEMBL3917734 0.85 KCNA5 (0.41) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4102234 0.83 NPC1 (0.42) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4105235 0.82 KCNA5 (0.39) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4108759 0.82 NPC1 (0.44) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4118325 0.82 KCNA5 (0.42) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4113537 0.81 KCNA5 (0.38) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL3915740 0.80 KCNA5 (0.44) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL4505375 0.80 NPC1 (0.42) NPC1MEN1KMT2AEPHX2RAB9A
SCHEMBL3915202 0.77 KCNA5 (0.54) NPC1MEN1KMT2ARAB9AL3MBTL1
SCHEMBL3917221 0.77 KCNA5 (0.45) KCNA5MMP1MMP9MMP13GSK3A

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