SCHEMBL5116353

SCHEMBL5116353

Oc1ccc[c]c1C1([C@@H]2CCN(CCc3ccc4c(c3)OCO4)C2)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
ADRA1D P25100 3/20 0.38
ADRA1A P35348 3/20 0.38
ADRA1B P35368 3/20 0.38
CALM1 P0DP23 2/20 0.36
MCHR1 Q99705 1/20 0.36
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
SLC18A3 Q16572 1/20 0.35
TSHR P16473 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
SCHEMBL5127863 0.87 CHRM5 (0.48) MEN1KMT2AKDM4EADRA1AOPRM1
SCHEMBL5121405 0.76 SIGMAR1 (0.42) MEN1KMT2AKDM4EMAPK1MCHR1
SCHEMBL5117815 0.71 CHRM3 (0.45) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL5117812 0.71 CHRM3 (0.45) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL6802893 0.70 HRH3 (0.50) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL5121398 0.69 KMT2A (0.43) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL6270367 0.69 ALDH1A1 (0.47) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL5918372 0.69 ADRA1D (0.46) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL5918375 0.69 ADRA1D (0.46) MEN1KMT2AKDM4EMAPK1ADRA1D
SCHEMBL4391727 0.69 ALDH1A1 (0.49) MEN1KMT2AKDM4EMAPK1ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465751-B2 1-substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2008-12-16 US disclosed
US-20060194862-A1 1-Substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists RANBAXY LABORATORIES LIMITED (IN) 2006-08-31 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-20060194862-A1 1-Substituted-3-pyrrolidine derivatives as muscarinic receptor antagonists CHRM3, CHRM1, CHRM5 MEN1 1478/4885KMT2A 3693/4885KDM4E 2198/4885

“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.