SCHEMBL3243187

SCHEMBL3243187

COc1ccc2nccc(C(O)CN3CCC(N)[C@H](F)C3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 8/20 0.53
SLC2A1 P11166 4/20 0.53

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
SCHEMBL3243186 1.00 KCNH2 (0.53) KCNH2SLC2A1
SCHEMBL5256973 0.88 KCNH2 (0.60) KCNH2SLC2A1
SCHEMBL5252383 0.88 KCNH2 (0.60) KCNH2SLC2A1
SCHEMBL5256971 0.88 KCNH2 (0.60) KCNH2SLC2A1
Hydrochloric Acid SCHEMBL5253585 0.87 KCNH2 (0.59) KCNH2SLC2A1
SCHEMBL3273252 0.85 KCNH2 (0.55) KCNH2SLC2A1
SCHEMBL3272105 0.85 KCNH2 (0.55) KCNH2SLC2A1
Oxalic Acid SCHEMBL5418955 0.84 SLC2A1 (0.64) KCNH2SLC2A1
SCHEMBL5798553 0.83 KCNH2 (0.56) KCNH2SLC2A1
SCHEMBL5657534 0.81 SLC2A1 (0.55) KCNH2SLC2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181996-A1 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2010-05-05 EP disclosed
US-7312212-B2 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2007-12-25 US disclosed
US-7109213-B2 Aminopiperidine compounds, process for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 2006-09-19 US disclosed
US-20050159411-A1 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2005-07-21 US disclosed
US-20050085494-A1 Aminopiperidine compounds, process for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 2005-04-21 US disclosed
EP-1470131-A2 AMINOPIPERIDINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 2004-10-27 EP disclosed
EP-1470125-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2004-10-27 EP disclosed
WO-2003064421-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-08-07 WO disclosed
WO-2003064431-A2 AMINOPIPERIDINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 2003-08-07 WO 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-20050085494-A1 Aminopiperidine compounds, process for their preparation, and pharmaceutical compositions containing them NPEPPS, AASDHPPT, DNPEP KCNH2 839/4885SLC2A1 3418/4885
US-20050159411-A1 Aminopiperidine derivatives AMPD2, AMPD3, NPEPPS KCNH2 1182/4885SLC2A1 3708/4885

“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.