SCHEMBL8908635

SCHEMBL8908635

Nc1cc[n+](CCC[n+]2ccc(N)c3ccccc32)c2ccccc12

nearest known ligand 0.89

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHKA P35790 3/20 0.58
BCHE P06276 2/20 0.50
ACHE P22303 2/20 0.50

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
Iodide SCHEMBL14740486 0.98 CHKA (0.57) CHKABCHEACHE
SCHEMBL8912820 0.96 CHKA (0.58) CHKABCHEACHE
Iodide SCHEMBL14739303 0.94 CHKA (0.57) CHKA
SCHEMBL8907460 0.94 CHKA (0.57) CHKABCHEACHE
SCHEMBL17021411 0.94 CHKA (0.57) CHKABCHEACHE
SCHEMBL8908331 0.94 CHKA (0.57) CHKABCHEACHE
Iodide SCHEMBL14738732 0.93 CHKA (0.55) CHKA
Iodide SCHEMBL14740375 0.93 CHKA (0.55) CHKA
Iodide SCHEMBL2329322 0.93 CHKA (0.55) CHKA
Bromide SCHEMBL18334835 0.93 CHKA (0.59) CHKABCHEACHE

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-1997048705-A1 POTASSIUM CHANNEL BLOCKERS UNIVERSITY COLLEGE LONDON (GB) 1997-12-24 WO disclosed