SCHEMBL4186858

SCHEMBL4186858

O=C(OC1C2CCC1CN(Cc1ccccc1)C2)C(O)(c1ccc(F)cc1)C1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.48
CHRM3 P20309 2/20 0.48
CHRM1 P11229 1/20 0.48
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46

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
SCHEMBL4190990 0.93 CHRM2 (0.54) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL4193800 0.92 CHRM2 (0.53) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL4195838 0.90 CHRM2 (0.53) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL4193478 0.82 CACNA1G (0.43)
SCHEMBL4193583 0.81 CHRM2 (0.57) CHRM2CHRM3CHRM1
SCHEMBL4176964 0.80 ALDH1A1 (0.51) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL4179648 0.78 CHRM3 (0.53) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL4186539 0.78 CHRM3 (0.57) CHRM2CHRM3CHRM1
SCHEMBL3214986 0.78 HTT (0.53) CHRM2CHRM3CHRM1ALDH1A1CYP1A2
SCHEMBL3222150 0.78 HTT (0.53) CHRM2CHRM3CHRM1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 US claimed
EP-1797040-A1 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-06-20 EP claimed
WO-2006035303-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-04-06 WO claimed
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 US disclosed
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 US disclosed
US-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2009-04-23 US disclosed
EP-1797040-A1 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-06-20 EP disclosed
WO-2006035303-A1 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-04-06 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-20090105221-A1 MUSCARINIC RECEPTOR ANTAGONISTS CHRM3, CHRM5, CHRM2 CHRM2 3/4885CHRM3 1/4885CHRM1 4/4885

“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.