SCHEMBL3226891

SCHEMBL3226891

Cc1ccc(C(O)(C(=O)OCC2C3CCC2C[N+](C)(Cc2ccccc2)C3)c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 15/20 0.47
CHRM2 P08172 15/20 0.47
CYP2D6 P10635 3/20 0.43
KCNH2 Q12809 3/20 0.43
CHRM1 P11229 2/20 0.43
LMNA P02545 2/20 0.43
HRH1 P35367 1/20 0.43
SLC6A4 P31645 2/20 0.43
CHRM4 P08173 1/20 0.43
CHRM5 P08912 1/20 0.43
RAB9A P51151 1/20 0.43
CYP2C19 P33261 1/20 0.42
SLC22A1 O15245 1/20 0.41

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
SCHEMBL3219706 0.92 CHRM3 (0.45) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3213540 0.89 CHRM3 (0.46) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3210034 0.89 CHRM2 (0.49) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3224624 0.82 POLB (0.52) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3224057 0.82 POLB (0.52) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3226484 0.81 CHRM3 (0.44) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3224771 0.81 CHRM2 (0.47) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3216742 0.80 CHRM3 (0.46) CHRM3CHRM2CYP2D6KCNH2CHRM1
SCHEMBL3216719 0.80 CHRM3 (0.61) CHRM3HRH1
SCHEMBL3216726 0.79 ALDH1A1 (0.49) CHRM3CHRM2CHRM1CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056496-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-03-04 US claimed
EP-2059505-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2009-05-20 EP claimed
WO-2008029349-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2008-03-13 WO claimed
US-20100056496-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-03-04 US disclosed
EP-2059505-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2009-05-20 EP disclosed
WO-2008029349-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2008-03-13 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-20100056496-A1 MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 CHRM3 1/4885CHRM2 3/4885CYP2D6 316/4885

“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.