SCHEMBL4880745

SCHEMBL4880745

OC(CNC1C2CNCC21)C(O)(c1ccccc1)C1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
CYP2D6 P10635 5/20 0.36
CHRM2 P08172 4/20 0.36
CHRM1 P11229 4/20 0.36
CHRM3 P20309 3/20 0.36
KCNH2 Q12809 3/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
HRH1 P35367 2/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL4882115 0.82 SSTR4 (0.39) MEN1KMT2ACYP2D6CHRM3HRH1
SCHEMBL4886206 0.81 CHRM2 (0.43) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL4888621 0.74 CYP2D6 (0.36) MEN1KMT2AKEAP1NFE2L2CYP2D6
SCHEMBL4886929 0.71 ALDH1A1 (0.46) MEN1KMT2AKEAP1NFE2L2CYP2D6
SCHEMBL4889815 0.70 MEN1 (0.52) MEN1KMT2ACYP2D6CHRM2CHRM1
SCHEMBL4889726 0.70 ALDH1A1 (0.49) MEN1KMT2AKEAP1NFE2L2CYP2D6
SCHEMBL4076565 0.69 KEAP1 (0.57) KEAP1NFE2L2CHRM2CHRM1CHRM3
SCHEMBL5948024 0.69 KEAP1 (0.57) KEAP1NFE2L2CHRM2CHRM1CHRM3
SCHEMBL4889873 0.69 MEN1 (0.56) MEN1KMT2ACYP2D6CHRM2CHRM1
SCHEMBL5948317 0.68 KEAP1 (0.56) KEAP1NFE2L2CHRM2CHRM1CHRM3

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-20080280883-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-13 US claimed
EP-1794161-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-06-13 EP claimed
WO-2006032994-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-03-30 WO claimed
US-20080280883-A1 Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-11-13 US disclosed
EP-1794161-A2 MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-06-13 EP disclosed
WO-2006032994-A2 MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-03-30 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-20080280883-A1 Muscarinic Receptor Antagonists CHRM3, CHRM5, CHRM2 MEN1 1629/4885KMT2A 2763/4885KEAP1 1713/4885

“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.