SCHEMBL7976330

SCHEMBL7976330

CC(N)C(=O)N1CCN(CCCOc2ccc(Br)cc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 18/20 0.71
HRH1 P35367 18/20 0.71
HRH3 Q9Y5N1 1/20 0.71
RAB9A P51151 1/20 0.59
DRD2 P14416 1/20 0.53

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
SCHEMBL7250885 1.00 HRH2 (0.71) HRH2HRH1HRH3RAB9ADRD2
SCHEMBL7244819 1.00 HRH2 (0.71) HRH2HRH1HRH3RAB9ADRD2
SCHEMBL7248246 0.87 HRH2 (0.76) HRH2HRH1HRH3
SCHEMBL7976390 0.85 HRH1 (0.67) HRH2HRH1HRH3
SCHEMBL7978302 0.84 HRH2 (0.61) HRH2HRH1HRH3RAB9A
SCHEMBL7243588 0.84 HRH2 (0.61) HRH2HRH1HRH3RAB9A
SCHEMBL7245178 0.84 HRH2 (0.61) HRH2HRH1HRH3RAB9A
SCHEMBL7248482 0.83 HRH2 (1.00) HRH2HRH1HRH3
SCHEMBL7242852 0.83 HRH1 (0.70) HRH2HRH1HRH3
SCHEMBL7244264 0.83 HRH2 (1.00) HRH2HRH1HRH3

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
WO-2001066534-A2 CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2001-09-13 WO claimed
WO-2001066534-A2 CYCLIC AND BICYCLIC DIAMINO HISTAMINE-3 RECEPTOR ANTAGONISTS ABBOTT LABORATORIES (US) 2001-09-13 WO disclosed