SCHEMBL3618917

SCHEMBL3618917

CN(C(=O)O)C1C2CN(C(=O)C(O)(c3ccccc3)c3ccccc3)CC21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CHRM3 P20309 9/20 0.37
CHRM2 P08172 8/20 0.36
CHRM1 P11229 5/20 0.36
CHRM4 P08173 3/20 0.36
CHRM5 P08912 3/20 0.36
LMNA P02545 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL13545706 0.85 USP30 (0.38) ALDH1A1CHRM3CHRM2CHRM1CHRM4
SCHEMBL3616009 0.82 CHRM3 (0.59) ALDH1A1CHRM3CHRM2CHRM1CYP2D6
SCHEMBL3608809 0.78 CHRM3 (0.43) ALDH1A1CHRM3CHRM2CHRM1CHRM4
SCHEMBL5243856 0.74 CHRM3 (0.43) ALDH1A1CHRM3CHRM2CHRM1CHRM4
SCHEMBL3620063 0.74 CNR1 (0.39) ALDH1A1CHRM3CHRM2CHRM1LMNA
SCHEMBL3618915 0.71 CNR1 (0.42) CHRM3CHRM2CHRM1CHRM4CHRM5
SCHEMBL3620974 0.71 CHRM3 (0.62) ALDH1A1CHRM3CHRM2CHRM1
SCHEMBL13545705 0.70 CHRM3 (0.53) ALDH1A1CHRM3CHRM2CHRM1
SCHEMBL1014405 0.70 FUCA1 (0.53)
SCHEMBL3621284 0.66 CHRM3 (0.49) ALDH1A1CHRM3CHRM2CHRM1LMNA

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-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-01-21 US claimed
EP-1828174-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-09-05 EP claimed
WO-2006054162-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-05-26 WO claimed
US-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2010-01-21 US disclosed
EP-1828174-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-09-05 EP disclosed
WO-2006054162-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-05-26 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-20100016400-A1 AZABICYCLIC MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 ALDH1A1 1337/4885CHRM3 1/4885CHRM2 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.