SCHEMBL5347497

SCHEMBL5347497

C1CN[C@H](CSC[C@@H]2CCCN2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
MLNR O43193 1/20 0.39
ABCB11 O95342 1/20 0.39
EGFR P00533 1/20 0.39
FYN P06241 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
HTR1A P08908 1/20 0.39
CHRM5 P08912 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
ADRA2B P18089 1/20 0.39

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
SCHEMBL10351271 0.86
SCHEMBL3330569 0.80
SCHEMBL22871208 0.80
SCHEMBL23251393 0.80
SCHEMBL10351818 0.80 CYP2D6 (0.41) CYP2D6MEN1ALDH1A1LMNATP53
SCHEMBL16553312 0.80 CYP2D6 (0.39) CYP2D6MEN1ALDH1A1LMNATP53
SCHEMBL27663525 0.75 CYP2D6 (0.43) CYP2D6MEN1ALDH1A1LMNATP53
SCHEMBL13961615 0.75 CYP2D6 (0.43) CYP2D6MEN1ALDH1A1LMNATP53
SCHEMBL2279513 0.75 CYP2D6 (0.43) CYP2D6MEN1ALDH1A1LMNATP53
SCHEMBL27577662 0.75 CYP2D6 (0.43) CYP2D6MEN1ALDH1A1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244852-B2 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof ABBOTT LABORATORIES (US) 2007-07-17 US disclosed
EP-1601650-A2 PROCESS FOR PREPARING 2-METHYLPYRROLIDINE AND SPECIFIC ENANTIOMERS THEREOF Abbott Laboratories (US) 2005-12-07 EP disclosed
US-20040260100-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof ABBVIE INC. 2004-12-23 US disclosed
WO-2004076388-A2 PROCESS FOR PREPARING 2-METHYLPYRROLIDINE AND SPECIFIC ENANTIOMERS THEREOF ABBOTT LABORATORIES (US) 2004-09-10 WO disclosed
US-20040171845-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof ABBOTT LABORATORIES 2004-09-02 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 (2 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-20040171845-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof QDPR, PNMT, MTAP CYP2D6 10/4885MEN1 2026/4885ALDH1A1 1193/4885
US-20040260100-A1 Process for preparing 2-methylpyrrolidine and specific enantiomers thereof QDPR, PNMT, MTAP CYP2D6 10/4885MEN1 2026/4885ALDH1A1 1193/4885

“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.