SCHEMBL1978872

SCHEMBL1978872

N#Cc1ccc(OCCCN2CC3CCCC32)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.57
HRH2 P25021 15/20 0.56
HRH1 P35367 15/20 0.56
MEN1 O00255 1/20 0.47

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
SCHEMBL1978873 1.00 HRH3 (0.57) HRH3HRH2HRH1MEN1
SCHEMBL1978869 1.00 HRH3 (0.57) HRH3HRH2HRH1MEN1
SCHEMBL1981459 0.86 HRH3 (0.47) HRH3HRH2HRH1
SCHEMBL14150224 0.83 HRH3 (0.68) HRH3HRH2HRH1MEN1
SCHEMBL4491586 0.83 HRH3 (0.68) HRH3HRH2HRH1MEN1
SCHEMBL1981461 0.81 HRH3 (0.47) HRH3MEN1
SCHEMBL4494406 0.81 HRH3 (0.68) HRH3HRH2HRH1MEN1
SCHEMBL4684886 0.80 HRH3 (0.66) HRH3HRH2HRH1MEN1
SCHEMBL1981428 0.79 HRH3 (0.57) HRH3HRH2HRH1MEN1
SCHEMBL1981431 0.79 HRH3 (0.57) HRH3HRH2HRH1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011070252-A1 AZABICYCLO[3.2.0]HEPT-6-YL DERIVATIVES AS ANTAGONISTS OF HISTAMINE H3 RECEPTOR LES LABORATOIRES SERVIER (FR) 2011-06-16 WO disclosed