SCHEMBL9900151

SCHEMBL9900151

C[C@H]1CC[C@@H](CN)N(C(=O)O)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
LIPE Q05469 1/20 0.33
DPP4 P27487 1/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PEPD P12955 1/20 0.31
PLG P00747 1/20 0.31
PLAT P00750 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL13071925 0.85 HCRTR2 (0.33) KDM4ELIPELMNAALDH1A1SMN1; SMN2
SCHEMBL9928395 0.85 HCRTR2 (0.33) KDM4ELIPELMNAALDH1A1SMN1; SMN2
SCHEMBL25322253 0.83 POLB (0.41) LIPELMNAALDH1A1MAPT
SCHEMBL17892791 0.83 POLB (0.41) LIPELMNAALDH1A1MAPT
SCHEMBL9895421 0.83 POLB (0.41) LIPELMNAALDH1A1MAPT
SCHEMBL9898712 0.80 THRB (0.33) LMNAALDH1A1
Hydrochloric Acid SCHEMBL23189624 0.78
SCHEMBL18546124 0.77 HTT (0.34) KDM4ESMN1; SMN2
SCHEMBL8007592 0.77 NR1H2 (0.40) ALDH1A1SMN1; SMN2MAPT
SCHEMBL17686396 0.76

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
EP-2470525-A1 PIPERIDINE DERIVATIVES USED AS OREXIN ANTAGONISTS Glaxo Group Limited (GB) 2012-07-04 EP disclosed
US-20120149711-A1 PIPERIDINE DERIVATIVES USED AS OREXIN ANTAGONISTS GLAXO GROUP LIMITED 2012-06-14 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-20120149711-A1 PIPERIDINE DERIVATIVES USED AS OREXIN ANTAGONISTS HCRTR2, HCRTR1, OXTR KDM4E 499/4885LIPE 1828/4885DPP4 1889/4885

“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.