SCHEMBL4915142

SCHEMBL4915142

CN(CC1CCNC1)C(=O)C(O)(c1ccccc1)C1CCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.52
NFE2L2 Q16236 1/20 0.52
USP30 Q70CQ3 1/20 0.52
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.47
CHRM3 P20309 8/20 0.44
CHRM2 P08172 5/20 0.44
CHRM1 P11229 5/20 0.44
CYP3A4 P08684 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.41
CYP2C9 P11712 1/20 0.41
PKM P14618 1/20 0.41
NFKB1 P19838 1/20 0.41
THPO P40225 1/20 0.41
KCNH2 Q12809 1/20 0.41
ABCB11 O95342 1/20 0.41
ESR1 P03372 1/20 0.41
CHRM4 P08173 1/20 0.41

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
SCHEMBL4914500 0.99 KEAP1 (0.51) KEAP1NFE2L2USP30ALDH1A1POLB
SCHEMBL4921985 0.80 ALDH1A1 (0.57) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL25134509 0.79 KEAP1 (0.60) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL18196842 0.77 ALDH1A1 (0.65) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL4921989 0.76 KEAP1 (0.48) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL18196840 0.76 POLB (0.65) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL4923231 0.75 CHRM3 (0.56) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL20253541 0.75 ALDH1A1 (0.62) KEAP1NFE2L2ALDH1A1POLBCHRM3
SCHEMBL4921992 0.75 CHRM2 (0.55) KEAP1NFE2L2CHRM3CHRM2CHRM1
SCHEMBL4923244 0.75 ALDH1A1 (0.43) KEAP1NFE2L2ALDH1A1POLBCHRM3

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-20080262075-A1 Pyrrolidine Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-23 US claimed
EP-1781607-A2 PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-05-09 EP claimed
WO-2006018708-A2 PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-02-23 WO claimed
US-20080262075-A1 Pyrrolidine Derivatives as Muscarinic Receptor Antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-10-23 US disclosed
EP-1781607-A2 PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS Ranbaxy Laboratories Limited (IN) 2007-05-09 EP disclosed
WO-2006018708-A2 PYRROLIDINE DERIVATIVES AS MUSCARINIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2006-02-23 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-20080262075-A1 Pyrrolidine Derivatives as Muscarinic Receptor Antagonists CHRM3, CHRM2, CHRM5 KEAP1 2636/4885NFE2L2 4262/4885USP30 2109/4885

“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.