SCHEMBL662009

SCHEMBL662009

CN1CCC(OC(=O)Nc2cc(/C=C/C(=O)OC(C)(C)C)ccc2-c2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.61

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
SCHEMBL16868423 0.89 CHRM3 (0.68) CHRM3
SCHEMBL16868422 0.89 CHRM3 (0.68) CHRM3
Hydrochloric Acid SCHEMBL660333 0.88 CHRM3 (0.67) CHRM3
Hydrochloric Acid SCHEMBL660334 0.88 CHRM3 (0.67) CHRM3
SCHEMBL662011 0.82 CHRM3 (0.66) CHRM3
SCHEMBL98253 0.79 CHRM3 (0.48) CHRM3
SCHEMBL98252 0.79 CHRM3 (0.48) CHRM3
SCHEMBL98319 0.79 CHRM3 (0.61) CHRM3
SCHEMBL99560 0.79 CHRM3 (0.61) CHRM3
SCHEMBL169797 0.78 CHRM3 (0.49) CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120046467-A1 QUATERNARY AMMONIUM SALT COMPOUNDS TEIJIN PHARMA LIMITED (JP) 2012-02-23 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-20120046467-A1 QUATERNARY AMMONIUM SALT COMPOUNDS ADRB2, AGTR2, ADRB3 CHRM3 9/4885

“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.