SCHEMBL9967271

SCHEMBL9967271

CC(=O)[C@H]1CN2CCC1CC2

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 4/20 0.52
▸ CHRM1 P11229 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.50
▸ GAA P10253 1/20 0.45
▸ CHRNA7 P36544 1/20 0.44
▸ CHRM4 P08173 1/20 0.43
▸ CHRM5 P08912 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
SCHEMBL8236713 1.00 CHRM2 (0.52) CHRM2CHRM1MEN1CYP2D6KMT2A
Hydrochloric Acid SCHEMBL9444152 0.98 ALDH1A1 (0.53) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL8935492 0.89 CHRM2 (0.46) CHRM2CHRM1MEN1CYP2D6KMT2A
Acetic Acid SCHEMBL11614488 0.83 ALDH1A1 (0.51) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL28273440 0.81 ALDH1A1 (0.49) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL5171234 0.79 ALDH1A1 (0.51) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL2495325 0.79 ALDH1A1 (0.51) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL1617171 0.79 ALDH1A1 (0.51) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL13517084 0.77 ALDH1A1 (0.46) CHRM2CHRM1MEN1CYP2D6KMT2A
SCHEMBL5167294 0.77 ALDH1A1 (0.46) CHRM2CHRM1MEN1CYP2D6KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9867812-B2 N-biarylamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2018-01-16 — — US disclosed
US-20160310474-A1 N-BIARYLAMIDES BAYER HEALTHCARE AG (DE) 2016-10-27 — — US disclosed
US-9227964-B2 N-biarylamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-05 — — US disclosed
US-20140288118-A1 N-BIARYLAMIDES BAYER INTELLECTUAL PROPERTY GMBH 2014-09-25 — — US disclosed
US-20120157490-A1 N-BIARYLAMIDES BAYER HEALTHCARE AG (DE) 2012-06-21 — — US disclosed
US-8030329-B2 N-biarylamides BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-10-04 — — US disclosed
US-20080214602-A1 (3R)-N-(4'-Aminobiphenyl-4-yl)quinuclidine--3-carboxamide dihydrochloride; nicotinic acetylcholine receptors of alpha7 subtype agonist; high permeability for calcium ions, increases glutamatergic neurotransmission, modulates neuronal plasticity; cognition activator, learning and perception enhancement BAYER HEALTHCARE AG (DE) 2008-09-04 — — US disclosed
US-7354930-B2 N-biarylamides BAYER HEALTHCARE AG (DE) 2008-04-08 — — US disclosed
US-20070112023-A1 (3R)-N-(4'-Aminobiphenyl-4-yl)quinuclidine-3-carboxamide dihydrochloride; nicotinic acetylcholine receptors of alpha7 subtype agonist; high permeability for calcium ions, increases glutamatergic neurotransmission, modulates neuronal plasticity; cognition activator, leaning and perception inhancement BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2007-05-17 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070112023-A1 (3R)-N-(4'-Aminobiphenyl-4-yl)quinuclidine-3-carboxamide dihydrochloride; nicotinic acetylcholine receptors of alpha7 subtype agonist; high permeability for calcium ions, increases glutamatergic neurotransmission, modulates neuronal plasticity; cognition activator, leaning and perception inhancement CHRNA7, CHRNA3, CHRNA5 CHRM2 45/4885CHRM1 42/4885MEN1 4500/4885
US-20140288118-A1 N-BIARYLAMIDES BCHE, BACE2, ACHE CHRM2 479/4885CHRM1 919/4885MEN1 2378/4885
US-20120157490-A1 N-BIARYLAMIDES GRIN2A, BCHE, ACHE CHRM2 127/4885CHRM1 171/4885MEN1 3205/4885
US-20160310474-A1 N-BIARYLAMIDES BCHE, BACE2, ACHE CHRM2 479/4885CHRM1 919/4885MEN1 2378/4885
US-20080214602-A1 (3R)-N-(4'-Aminobiphenyl-4-yl)quinuclidine--3-carboxamide dihydrochloride; nicotinic acetylcholine receptors of alpha7 subtype agonist; high permeability for calcium ions, increases glutamatergic neurotransmission, modulates neuronal plasticity; cognition activator, learning and perception enhancement CHRNA7, CHRNA3, CHRNA2 CHRM2 66/4885CHRM1 67/4885MEN1 4712/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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