SCHEMBL9459266

SCHEMBL9459266

Cc1cnc(C)c(C2(Cl)CN3CCC2C3)n1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.37
HTR3A P46098 7/20 0.33

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
SCHEMBL9459183 0.89 CHRM2 (0.37) CHRM2HTR3A
SCHEMBL9459319 0.84 HTR3A (0.39) CHRM2HTR3A
SCHEMBL9459086 0.82 CHRM2 (0.40) CHRM2
SCHEMBL9458880 0.81 KMT2A (0.40) CHRM2
SCHEMBL9459392 0.81 CHRM2 (0.37) CHRM2HTR3A
SCHEMBL9458876 0.78 HTR3A (0.40) CHRM2HTR3A
SCHEMBL9458894 0.75 HTR3A (0.43) CHRM2HTR3A
SCHEMBL9458830 0.74 CHRM2 (0.34) CHRM2HTR3A
SCHEMBL9458909 0.72 KMT2A (0.40) CHRM2
SCHEMBL9459215 0.70 HTR3A (0.39) CHRM2HTR3A

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 2 patents. 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
EP-0327155-A2 Pyrazines, pyrimidines and pyridazines, useful in the treatment of senile dementia MERCK SHARP & DOHME LTD. (GB) 1989-08-09 EP disclosed