SCHEMBL5209611

SCHEMBL5209611

CC(C)N1CCC(OC2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.42
KCNH2 Q12809 3/20 0.42
CYP2D6 P10635 2/20 0.42
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL5208600 0.83 HRH3 (0.41) HRH3
SCHEMBL4487226 0.83 HRH3 (0.46) HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL26501052 0.82 HRH3 (0.44) HRH3
SCHEMBL3412779 0.76 HRH3 (0.48) HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL14634313 0.76 NPC1 (0.35)
SCHEMBL5268205 0.76 MEN1 (0.36) HRH3KCNH2CYP2D6ALDH1A1
SCHEMBL2554592 0.76 NPC1 (0.35)
SCHEMBL1936071 0.75 CHRM3 (0.44) CYP2D6ALDH1A1
SCHEMBL4475509 0.75 HRH3 (0.49) HRH3KCNH2CYP2D6
SCHEMBL12026450 0.75 HRH3 (0.45) HRH3KCNH2CYP2D6

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 4 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 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 1/4885KCNH2 353/4885CYP2D6 2808/4885

“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.