SCHEMBL13865294

SCHEMBL13865294

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

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.34
ALDH1A1 P00352 3/20 0.33
ACE P12821 5/20 0.32
LMNA P02545 1/20 0.32
REN P00797 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL16401070 1.00 ATM (0.34) ATMALDH1A1ACELMNAREN
Hydrochloric Acid SCHEMBL25332117 0.98 ATM (0.33) ATMALDH1A1ACELMNAREN
SCHEMBL13865296 0.81 EPHX1 (0.35) ALDH1A1LMNA
SCHEMBL1101660 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL4072231 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL29108935 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL24354973 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL13164365 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL10330907 0.80 ATM (0.44) ATMALDH1A1ACE
SCHEMBL18065044 0.78 ATM (0.42) ATMALDH1A1ACEREN

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 ATM 2339/4885ALDH1A1 1789/4885ACE 216/4885

“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.