SCHEMBL9431069

SCHEMBL9431069

c1cc(C2CN3CCC2CC3)ccn1

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.67
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46

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
SCHEMBL6628801 0.80 CHRNA7 (0.66) CHRNA7
SCHEMBL3217359 0.80 CHRNA7 (1.00) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9458669 0.77 CHRNA7 (0.56) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL11300641 0.77 CHRNA7 (0.67) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9493360 0.77 CHRNA7 (0.61) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL873067 0.74 CHRNA7 (0.79) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL11296886 0.73 CHRNA7 (0.61) CHRNA7CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL8686664 0.73 CHRNA7 (0.77) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL19539401 0.73 CHRNA7 (0.61) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL9431290 0.73 CHRNA7 (0.44) CHRNA7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412798-A2 Substituted pyridines, their preparation, formulations and use in dementia MERCK SHARP & DOHME LTD. (GB) 1991-02-13 EP claimed
US-5346906-A Enhancement of cholinergic transmitters in treatment of neurological and mental disorders such as Alzheimer's MERCK SHARPE & DOHME LTD. (GB) 1994-09-13 US disclosed
EP-0412798-A2 Substituted pyridines, their preparation, formulations and use in dementia MERCK SHARP & DOHME LTD. (GB) 1991-02-13 EP disclosed