SCHEMBL3840915

SCHEMBL3840915

c1ccc2cc(-c3cnc(OC4CN5CCC4CC5)nc3)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 3/20 0.48
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43

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
SCHEMBL3840912 1.00 CHRNA7 (0.48) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL3844303 0.84 CHRNA7 (0.48) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL999498 0.84 CHRNA7 (0.48) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL999496 0.84 CHRNA7 (0.48) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL1459611 0.82 CHRNA7 (0.51) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL3839954 0.82 CHRM2 (0.47) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL1459609 0.82 CHRNA7 (0.51) CHRNA7CHRM2CHRM4CHRM5CHRM1
SCHEMBL372171 0.82 CHRNA7 (0.67) CHRNA7
SCHEMBL1542249 0.82 CHRNA7 (0.67) CHRNA7
SCHEMBL1542155 0.82 CHRNA7 (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537104-B1 AZA-BICYCLOALKYL ETHERS AND THEIR USE AS ALPHA7-NACHR AGONISTS NOVARTIS AG (CH) 2009-11-11 EP claimed