SCHEMBL13865291

SCHEMBL13865291

COC(=O)[C@@H]1CC[C@@H](C)CN1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.39
ANPEP P15144 1/20 0.39
BRD4 O60885 1/20 0.37
CYP2C19 P33261 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.35
CYP1A2 P05177 1/20 0.35
HIF1A Q16665 1/20 0.35
CYP3A4 P08684 2/20 0.35
MAPT P10636 2/20 0.35
PEPD P12955 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
SCHEMBL4071810 0.82 PEPD (0.44) MMP2ANPEPBRD4CYP2C19ALDH1A1
SCHEMBL12225959 0.82 PEPD (0.44) MMP2ANPEPBRD4CYP2C19ALDH1A1
SCHEMBL12860964 0.82 PEPD (0.44) MMP2ANPEPBRD4CYP2C19ALDH1A1
SCHEMBL12860970 0.82 PEPD (0.44) MMP2ANPEPBRD4CYP2C19ALDH1A1
SCHEMBL13865290 0.79 ANPEP (0.49) MMP2ANPEPBRD4ALDH1A1CYP1A2
SCHEMBL13865294 0.78 ATM (0.34) ALDH1A1MAPT
SCHEMBL16401070 0.78 ATM (0.34) ALDH1A1MAPT
SCHEMBL12765089 0.77
SCHEMBL10794700 0.77
SCHEMBL12891657 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131444-A1 Aminopiperidine Quinolines and Their Azaisosteric Analogues with Antibacterial Activity ASTRAZENECA AB (SE) 2009-05-21 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-20090131444-A1 Aminopiperidine Quinolines and Their Azaisosteric Analogues with Antibacterial Activity AAAS, AMPD2, AMPD3 MMP2 2536/4885ANPEP 63/4885BRD4 178/4885

“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.