SCHEMBL4597193

SCHEMBL4597193

CC1CCCCN1CCCOc1ccc(C2CCC(=O)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.69
MAOB P27338 1/20 0.58
HRH2 P25021 1/20 0.58
HRH1 P35367 1/20 0.58
KCNH2 Q12809 2/20 0.55

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
SCHEMBL4090519 0.83 HRH3 (0.97) HRH3KCNH2
SCHEMBL4090678 0.82 HRH3 (1.00) HRH3KCNH2
SCHEMBL4672757 0.81 HRH3 (0.62) HRH3MAOBHRH2HRH1KCNH2
SCHEMBL4094623 0.81 HRH3 (0.66) HRH3MAOBHRH2HRH1KCNH2
SCHEMBL4094626 0.81 HRH3 (0.66) HRH3MAOBHRH2HRH1KCNH2
SCHEMBL736582 0.80 HRH3 (0.62) HRH3KCNH2
SCHEMBL1776447 0.79 HRH3 (0.71) HRH3MAOBHRH2HRH1KCNH2
SCHEMBL20652676 0.79 HRH3 (0.67) HRH3MAOBHRH2HRH1KCNH2
SCHEMBL12128607 0.79 HRH3 (0.67) HRH3MAOBHRH2HRH1
SCHEMBL1777134 0.78 HRH3 (0.57) HRH3MAOBHRH2HRH1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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