SCHEMBL4240764

SCHEMBL4240764

COc1ccc(CN(C(=O)OCC2C3CCC2CN(Cc2ccccc2)C3)c2cccc(F)c2)cc1O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 7/20 0.46
CHRM3 P20309 7/20 0.46
CHRM2 P08172 6/20 0.46
ACHE P22303 2/20 0.44
KMT2A Q03164 2/20 0.42
CHRM5 P08912 3/20 0.41
OPRM1 P35372 1/20 0.39
KCNH2 Q12809 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
PTGIR P43119 1/20 0.38
PTGDR Q13258 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.38
QPCT Q16769 1/20 0.37

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
SCHEMBL4242091 0.93 CHRM1 (0.43) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4245725 0.89 PTGIR (0.47) ACHEKMT2APTGIRPTGDR
SCHEMBL4250571 0.88 CHRM2 (0.52) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4246952 0.88 CHRM2 (0.48) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4246887 0.87 CHRM1 (0.49) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4248307 0.86 CHRM2 (0.52) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4245844 0.85 ACHE (0.48) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4249813 0.84 ACHE (0.47) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4250524 0.82 ACHE (0.43) CHRM1CHRM3CHRM2ACHEKMT2A
SCHEMBL4237321 0.81 SIGMAR1 (0.44) CHRM1CHRM3CHRM2ACHECHRM5

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-20090012116-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2009-01-08 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-20090012116-A1 Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 CHRM1 5/4885CHRM3 1/4885CHRM2 2/4885

“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.