SCHEMBL7920314

SCHEMBL7920314

Cc1nccnc1C1(O)CN2CCC1CC2

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.54
CHRM2 P08172 5/20 0.54
CHRM4 P08173 5/20 0.54
CHRM5 P08912 5/20 0.54
CHRM3 P20309 5/20 0.54
KMT2A Q03164 1/20 0.53
HTR3A P46098 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
SCHEMBL9459105 0.91 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9225381 0.83 CHRM1 (0.52) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9226760 0.77 CHRM1 (0.44) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458720 0.75 KMT2A (0.62) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458880 0.75 KMT2A (0.40) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9458909 0.75 KMT2A (0.40) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9227574 0.74 CHRM1 (0.43) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9459135 0.74 CHRM1 (0.41) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9347006 0.70 CHRM1 (0.54) CHRM1CHRM2CHRM4CHRM5CHRM3
SCHEMBL9430809 0.70 CHRM1 (1.00) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871445-A4 COMPOSITION FOR TREATING PAIN LILLY CO ELI (US) 2001-01-10 EP disclosed
EP-0871445-A1 COMPOSITION FOR TREATING PAIN ELI LILLY AND COMPANY (US) 1998-10-21 EP disclosed
WO-1997020561-A1 COMPOSITION FOR TREATING PAIN ELI LILLY AND COMPANY (US) 1997-06-12 WO disclosed
US-5574053-A Method for treating anxiety ELI LILLY AND COMPANY (US) 1996-11-12 US disclosed
US-5574029-A Method for treating anxiety ELI LILLY AND COMPANY (US) 1996-11-12 US disclosed
US-5574028-A SEDATIVES ELI LILLY AND COMPANY (US) 1996-11-12 US disclosed
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