SCHEMBL3226484

SCHEMBL3226484

C[N+]1(Cc2ccccc2)CC2C(COC(=O)C(O)(c3ccccc3)c3ccc(F)cc3)C2C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 10/20 0.44
CHRM2 P08172 10/20 0.42
CYP2D6 P10635 3/20 0.41
KCNH2 Q12809 3/20 0.41
LMNA P02545 2/20 0.41
CHRM1 P11229 2/20 0.41
HRH1 P35367 1/20 0.41
RAB9A P51151 1/20 0.41
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC6A4 P31645 2/20 0.39
CYP2C19 P33261 1/20 0.39
SLC22A1 O15245 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 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
SCHEMBL3213540 0.92 CHRM3 (0.46) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3219706 0.90 CHRM3 (0.45) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3201421 0.83 CHRM3 (0.48) CHRM3CHRM2CHRM1
SCHEMBL3227028 0.81 PLK4 (0.38) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3226891 0.81 CHRM3 (0.47) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3224771 0.81 CHRM2 (0.47) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3222037 0.74 CHRM2 (0.45) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3226494 0.72 KCNA5 (0.34) CHRM3LMNASLC6A4
SCHEMBL3210004 0.71 CHRM2 (0.41) CHRM3CHRM2CYP2D6KCNH2LMNA
SCHEMBL3210034 0.71 CHRM2 (0.49) CHRM3CHRM2CYP2D6KCNH2LMNA

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.