SCHEMBL5208629

SCHEMBL5208629

N#Cc1ccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 15/20 0.48
L3MBTL3 Q96JM7 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LCAT P04180 1/20 0.38
PARP1 P09874 1/20 0.36
TNK2 Q07912 1/20 0.36
TNK1 Q13470 1/20 0.36
CHRM4 P08173 1/20 0.36
CDK1 P06493 1/20 0.36
CDK2 P24941 1/20 0.36
KCNH2 Q12809 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
Hydrochloric Acid SCHEMBL5210549 0.99 HRH3 (0.47) HRH3L3MBTL3L3MBTL1LCATPARP1
SCHEMBL4031344 0.86 HRH3 (0.42) HRH3L3MBTL3L3MBTL1LCATPARP1
SCHEMBL5209493 0.81 HRH3 (0.60) HRH3L3MBTL3L3MBTL1KCNH2
SCHEMBL5212466 0.81 HRH3 (0.48) HRH3LCAT
Hydrochloric Acid SCHEMBL5214091 0.80 HRH3 (0.59) HRH3L3MBTL3L3MBTL1KCNH2
Hydrochloric Acid SCHEMBL5211669 0.80 HRH3 (0.47) HRH3LCAT
SCHEMBL14431602 0.78 HRH3 (0.59) HRH3L3MBTL3L3MBTL1CHRM4
SCHEMBL5212095 0.78 HRH3 (0.48) HRH3L3MBTL3L3MBTL1LCATCHRM4
Hydrochloric Acid SCHEMBL5210871 0.77 HRH3 (0.47) HRH3L3MBTL3L3MBTL1LCATCHRM4
SCHEMBL5212817 0.77 HRH3 (0.61) HRH3

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
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP disclosed
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 1/4885L3MBTL3 3618/4885L3MBTL1 3919/4885

“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.