SCHEMBL5212438

SCHEMBL5212438

CNC(=O)c1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.60
PARP1 P09874 11/20 0.49
HRH1 P35367 1/20 0.47
PARP2 Q9UGN5 3/20 0.44
PARP6 Q2NL67 2/20 0.44
PARP3 Q9Y6F1 2/20 0.44
TIPARP Q7Z3E1 1/20 0.44
KCNH2 Q12809 1/20 0.43

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
Hydrochloric Acid SCHEMBL5211935 0.99 HRH3 (0.59) HRH3PARP1HRH1PARP2PARP6
SCHEMBL5210318 0.90 HRH3 (0.59) HRH3PARP1
SCHEMBL5213489 0.89 HRH3 (0.57) HRH3PARP1PARP2PARP6PARP3
SCHEMBL5209152 0.88 HRH3 (0.56) HRH3PARP1
SCHEMBL4032017 0.88 HRH3 (0.53) HRH3PARP1HRH1PARP2PARP6
SCHEMBL5210105 0.88 HRH3 (0.60) HRH3HRH1
SCHEMBL5211332 0.87 HRH3 (0.56) HRH3PARP1
SCHEMBL5210726 0.87 HRH3 (0.55) HRH3PARP1PARP2PARP6PARP3
SCHEMBL5212817 0.86 HRH3 (0.61) HRH3
SCHEMBL26015635 0.86 HRH3 (0.53) HRH3PARP1HRH1PARP2PARP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP claimed
US-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands BAILEY JAMES M 2006-11-02 US claimed
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP disclosed
US-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands BAILEY JAMES M 2006-11-02 US disclosed
EP-1646620-A1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2006-04-19 EP disclosed
WO-2005014571-A1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2005-02-17 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 (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-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands HRH3, HRH4, HRH1 HRH3 1/4885PARP1 1880/4885HRH1 3/4885

“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.