SCHEMBL5006856

SCHEMBL5006856

CCOC(=O)C[N+]12CCC(CC1)C(OC(=O)Nc1ccccc1Cc1ccccc1)C2

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 18/20 0.42
CHRM2 P08172 15/20 0.42
CHRM1 P11229 8/20 0.42
L3MBTL1 Q9Y468 1/20 0.40
TACR1 P25103 1/20 0.39

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
SCHEMBL5011098 0.88 CHRM3 (0.42) CHRM3CHRM2CHRM1L3MBTL1
SCHEMBL5007267 0.85 CHRM3 (0.55) CHRM3CHRM2CHRM1L3MBTL1
SCHEMBL5009300 0.84 CHRM2 (0.42) CHRM3CHRM2CHRM1L3MBTL1
SCHEMBL5007152 0.84 CHRM2 (0.44) CHRM3CHRM2CHRM1L3MBTL1
SCHEMBL6231206 0.82 CHRM2 (0.59) CHRM3CHRM2CHRM1L3MBTL1
SCHEMBL2813858 0.82 CHRM3 (0.59) CHRM3CHRM2CHRM1
SCHEMBL5003306 0.82 CHRM3 (0.59) CHRM3CHRM2CHRM1
SCHEMBL5011304 0.82 CHRM3 (0.44) CHRM3CHRM2CHRM1
Iodide SCHEMBL4090662 0.81 CHRM2 (0.58) CHRM3CHRM2CHRM1L3MBTL1
Bromide SCHEMBL2814286 0.81 CHRM3 (0.60) CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1461336-B1 1-ALKYL-1-AZONIABICYCLO (2.2.2) OCTANE CARBAMATE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARMA SPA (IT) 2013-05-22 EP disclosed
US-7452904-B2 1-alkyl-1-azoniabicyclo' 2.2.2 octane carbamate derivatives and their use as muscarinic receptor antagonists CHIESI FARMACEUTICI S.P.A. (IT) 2008-11-18 US disclosed
US-20050043349-A1 1-Alkyl-1-azoniabicyclo' 2.2.!octane carbamate derivatives and their use as muscarinic receptor antagonists LABORATORIOS S.A.L.V.A.T. (ES) 2005-02-24 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 (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-20050043349-A1 1-Alkyl-1-azoniabicyclo' 2.2.!octane carbamate derivatives and their use as muscarinic receptor antagonists CHRM2, CHRM3, CHRM1 CHRM3 2/4885CHRM2 1/4885CHRM1 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.