SCHEMBL8935510

SCHEMBL8935510

NCC(=O)C1CN2CCC1CC2

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 1/20 0.41
▸ PEPD P12955 1/20 0.41
▸ CHRM2 P08172 4/20 0.39
▸ CHRM1 P11229 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CHRM4 P08173 1/20 0.37
▸ CHRM5 P08912 1/20 0.37
▸ CHRM3 P20309 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
Hydrochloric Acid SCHEMBL8935476 0.98 ALDH1A1 (0.45) CHRNA7ALDH1A1GAAPEPDCHRM2
Hydrochloric Acid SCHEMBL8935473 0.89 PEPD (0.43) CHRNA7ALDH1A1PEPDCHRM2CHRM1
SCHEMBL15341643 0.80 ALDH1A1 (0.46) CHRNA7ALDH1A1GAACHRM2CHRM1
Bromide SCHEMBL9293836 0.78 ALDH1A1 (0.41) CHRNA7ALDH1A1GAACHRM2CHRM1
SCHEMBL261179 0.77 CHRNA7 (0.50) CHRNA7ALDH1A1GAACHRM2CHRM1
SCHEMBL260902 0.77 CHRNA7 (0.50) CHRNA7ALDH1A1GAACHRM2CHRM1
SCHEMBL260527 0.77 CHRNA7 (0.50) CHRNA7ALDH1A1GAACHRM2CHRM1
SCHEMBL8935448 0.77 CHRM2 (0.41) ALDH1A1GAACHRM2CHRM1MEN1
SCHEMBL28273440 0.76 ALDH1A1 (0.49) CHRNA7ALDH1A1GAACHRM2CHRM1
SCHEMBL8935442 0.76 ALDH1A1 (0.40) CHRNA7ALDH1A1GAACHRM2CHRM1

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
US-5541194-A PHARMACEUTICAL COMPOSTION USED TO TREAT DEMENTIA BEECHAM GROUP P.L.C. (GB) 1996-07-30 — — US disclosed
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