SCHEMBL3916097

SCHEMBL3916097

COc1ccc(CCN2C(=O)NCC2(NCc2ccnc(O)c2)c2ccc(C)c(C)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 7/20 0.48
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
HTT P42858 1/20 0.37
KCNH2 Q12809 1/20 0.35
MAPT P10636 3/20 0.35
TP53 P04637 1/20 0.35
LMNA P02545 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NR3C2 P08235 1/20 0.34
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 3/20 0.33
RIOK2 Q9BVS4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL3925887 0.90 KCNA5 (0.52) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3915648 0.87 KCNA5 (0.53) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3918373 0.86 KCNA5 (0.52) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3917567 0.85 KCNA5 (0.49) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3915640 0.84 KCNA5 (0.51) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3926770 0.84 KCNA5 (0.49) KCNA5MEN1KMT2AHTTLMNA
SCHEMBL3915650 0.84 KCNA5 (0.50) KCNA5MEN1KMT2AHTTKCNH2
SCHEMBL3918641 0.82 KCNA5 (0.45) KCNA5MEN1KMT2AHTTMAPT
SCHEMBL3914500 0.81 KCNA5 (0.52) KCNA5MEN1KMT2AKCNH2MAPT
SCHEMBL3925151 0.81 KCNA5 (0.52) KCNA5MEN1KMT2AHTTKCNH2

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