SCHEMBL4094287

SCHEMBL4094287

O=C(C=Cc1ccc(-c2ccc(OCCCN3CCCCC3)cc2)cc1)N1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.69
MAOB P27338 5/20 0.62
BCHE P06276 2/20 0.59
ACHE P22303 2/20 0.59
KCNH2 Q12809 3/20 0.57
HRH1 P35367 1/20 0.57
HRH4 Q9H3N8 1/20 0.56

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
SCHEMBL4094283 1.00 HRH3 (0.69) HRH3MAOBBCHEACHEKCNH2
SCHEMBL4098376 0.88 HRH3 (0.72) HRH3MAOBBCHEACHEKCNH2
SCHEMBL4098379 0.88 HRH3 (0.72) HRH3MAOBBCHEACHEKCNH2
SCHEMBL4090531 0.83 HRH3 (0.67) HRH3MAOBBCHEACHEKCNH2
SCHEMBL4090529 0.83 HRH3 (0.67) HRH3MAOBBCHEACHEKCNH2
SCHEMBL3115263 0.82 NPC1 (0.77) HRH3
SCHEMBL3122021 0.82 NPC1 (0.77) HRH3
SCHEMBL3115258 0.82 NPC1 (0.77) HRH3
SCHEMBL3122017 0.82 NPC1 (0.77) HRH3
SCHEMBL12050645 0.79 HRH3 (1.00) HRH3KCNH2HRH1HRH4

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-1874746-B1 DERIVATIVES OF 1-N-AZACYCLOALKYL-3-PHENOXYPROPANE USEFUL FOR THE PREPARATION OF PSYCHOTROPIC MEDICAMENTS BIOPROJET SOC CIV (FR) 2015-11-18 EP disclosed
US-8076329-B2 Histamine H3-receptor ligands and their therapeutic applications BIOPROJET (FR) 2011-12-13 US disclosed
US-20090111808-A1 NOVEL HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS BIOPROJET (FR) 2009-04-30 US disclosed
EP-1874746-A2 NOVEL HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS BIOPROJET (FR) 2008-01-09 EP disclosed
WO-2006117609-A2 PHENOXYPROPYLPIPERIDINES AND -PYRROLIDINES AND THEIR USE AS HISTAMINE H3 -RECEPTOR LIGANDS BIOPROJET (FR) 2006-11-09 WO disclosed
EP-1717235-A2 Phenoxypropylpiperidines and -pyrrolidines and their use as histamine H3-receptor ligands BIOPROJET (FR) 2006-11-02 EP 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-20090111808-A1 NOVEL HISTAMINE H3-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS HRH3, HRH4, HRH1 HRH3 1/4885MAOB 342/4885BCHE 148/4885

“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.