SCHEMBL2148232

SCHEMBL2148232

CCOC(=O)N1C2CCC1CC(=NO)C2

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 17/20 0.41
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
GRM5 P41594 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL1016674 0.81 CHRM1 (0.42) CHRM1CHRM4CHRM5GRM5CHRM2
SCHEMBL15618675 0.81 CHRM1 (0.42) CHRM1CHRM4CHRM5GRM5CHRM2
SCHEMBL4312871 0.80 CHRM2 (0.58) CHRM1CHRM2CHRM3
SCHEMBL30068303 0.80 CHRM2 (0.58) CHRM1CHRM2CHRM3
SCHEMBL3745563 0.75 MAPK1 (0.48) CHRM1CHRM4CHRM5GRM5
SCHEMBL17354962 0.74 CHRM1 (0.51) CHRM1CHRM4CHRM5GRM5
SCHEMBL10063523 0.74 CHRM1 (0.51) CHRM1CHRM4CHRM5GRM5
SCHEMBL3132747 0.74 CHRM1 (0.38) CHRM1CHRM4CHRM5GRM5
SCHEMBL19728175 0.74 CHRM2 (0.51) CHRM1CHRM2CHRM3
SCHEMBL17592860 0.74 CHRM2 (0.51) CHRM1CHRM2CHRM3

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
US-8697691-B2 Alkyl 3-((2-amidoethyl)amino)-8-azabicyclo[3.2.1]octane-8-carboxylate analogs as selective M1 agonists and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
US-8697691-B2 Alkyl 3-((2-amidoethyl)amino)-8-azabicyclo[3.2.1]octane-8-carboxylate analogs as selective M1 agonists and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
US-8697691-B2 Alkyl 3-((2-amidoethyl)amino)-8-azabicyclo[3.2.1]octane-8-carboxylate analogs as selective M1 agonists and methods of making and using same VANDERBILT UNIVERSITY (US) 2014-04-15 US disclosed
WO-2011087812-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY (US) 2011-07-21 WO disclosed
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY 2011-07-14 US disclosed
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY 2011-07-14 US disclosed
US-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME VANDERBILT UNIVERSITY 2011-07-14 US disclosed
WO-2007087204-A2 HETEROCYCLES AS NICOTINIC ACID RECEPTOR AGONISTS FOR THE TREATMENT OF DYYSLIPIDEMIA SCHERING CORPOORATION (US) 2007-08-02 WO 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 (1 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-20110172227-A1 ALKYL 3-((2-AMIDOETHYL)AMINO)-8-AZABICYCLO[3.2.1]OCTANE-8-CARBOXYLATE ANALOGS AS SELECTIVE M1 AGONISTS AND METHODS OF MAKING AND USING SAME CHRM1, CHRM2, CHRM5 CHRM1 1/4885CHRM4 4/4885CHRM5 3/4885

“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.