SCHEMBL4670797

SCHEMBL4670797

N#Cc1ccc(C(=O)N2CC=C(c3ccc(OCCCN4CCCCC4)cc3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.62
HRH1 P35367 5/20 0.61
CYP2D6 P10635 1/20 0.61
HRH2 P25021 4/20 0.60
KCNH2 Q12809 3/20 0.58
KCNA5 P22460 1/20 0.53
MAOB P27338 1/20 0.51

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
SCHEMBL4670397 0.91 HRH3 (0.75) HRH3KCNH2
SCHEMBL4670412 0.88 HRH3 (0.64) HRH3KCNH2
SCHEMBL4670379 0.85 HRH3 (0.63) HRH3HRH1KCNH2
SCHEMBL4673196 0.81 HRH3 (0.61) HRH3HRH1KCNH2
SCHEMBL4670358 0.81 HRH3 (0.61) HRH3HRH1KCNH2
SCHEMBL4224193 0.80 HRH3 (0.61) HRH3HRH1CYP2D6HRH2KCNH2
SCHEMBL14565799 0.80 HRH3 (0.73) HRH3HRH1CYP2D6HRH2KCNH2
Hydrochloric Acid SCHEMBL4233278 0.80 HRH3 (0.61) HRH3HRH1CYP2D6HRH2KCNH2
SCHEMBL4229736 0.79 HRH3 (0.63) HRH3HRH1CYP2D6HRH2KCNH2
SCHEMBL4229884 0.79 HRH3 (0.63) HRH3HRH1CYP2D6HRH2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1610786-B9 4-(4-(HETEROCYCLYLALKOXY PHENYL)-1-(HETEROCYCLYL-CARBONYL)PIPERIDINE DERIVATIVES AND RELATED COMPOUNDS AS HISTAMINE H3 ANTAGONISTS FOR THE TREATMENT OF NEUROLOGICAL DISEASES SUCH AS ALZHEIMER'S GLAXO GROUP LTD (GB) 2008-02-27 EP claimed
EP-1610786-B1 4-(4-(HETEROCYCLYLALKOXY PHENYL)-1-(HETEROCYCLYL-CARBONYL)PIPERIDINE DERIVATIVES AND RELATED COMPOUNDS AS HISTAMINE H3 ANTAGONISTS FOR THE TREATMENT OF NEUROLOGICAL DISEASES SUCH AS ALZHEIMER'S GLAXO GROUP LTD (GB) 2007-06-20 EP claimed
US-20060205774-A1 4-(4-(Heterocyclylakoxy) phenyl-1-(heterocyclyl-carbonyl) piperidine derivavites and related compounds as histamine h3 antagonists for the treatment of neurological diseases such as alzheimer's GLAXO GROUP LIMITED (GB) 2006-09-14 US claimed

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-20060205774-A1 4-(4-(Heterocyclylakoxy) phenyl-1-(heterocyclyl-carbonyl) piperidine derivavites and related compounds as histamine h3 antagonists for the treatment of neurological diseases such as alzheimer's HRH3, HRH4, HRH1 HRH3 1/4885HRH1 3/4885CYP2D6 1992/4885

“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.