SCHEMBL9459135

SCHEMBL9459135

CCc1nccnc1C1(O)CN2CCC1C2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.41
CHRM2 P08172 6/20 0.41
CHRM4 P08173 5/20 0.41
CHRM5 P08912 5/20 0.41
CHRM3 P20309 5/20 0.41
KMT2A Q03164 1/20 0.40

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
SCHEMBL9459105 0.83 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458830 0.81 CHRM2 (0.34) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9227574 0.79 CHRM1 (0.43) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9231097 0.77 CHRM1 (0.50) CHRM1CHRM2
SCHEMBL9458880 0.74 KMT2A (0.40) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458909 0.74 KMT2A (0.40) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL7920314 0.74 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9459148 0.73 KMT2A (0.41) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458896 0.70 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9226760 0.70 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3

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-5260293-A Simulate central muscarinic acetlycholine receptors MERCK SHARP & DOHME LIMITED (GB) 1993-11-09 US disclosed