SCHEMBL7976390

SCHEMBL7976390

C[C@@H](N)C(=O)N1CCN(CCCOc2ccc(CC=O)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 20/20 0.67
HRH2 P25021 19/20 0.67
HRH3 Q9Y5N1 2/20 0.67

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
SCHEMBL7244819 0.85 HRH2 (0.71) HRH1HRH2HRH3
SCHEMBL7250885 0.85 HRH2 (0.71) HRH1HRH2HRH3
SCHEMBL7976330 0.85 HRH2 (0.71) HRH1HRH2HRH3
SCHEMBL7248246 0.84 HRH2 (0.76) HRH1HRH2HRH3
SCHEMBL7979703 0.83 HRH2 (0.66) HRH1HRH2HRH3
SCHEMBL7244264 0.80 HRH2 (1.00) HRH1HRH2HRH3
SCHEMBL7242852 0.80 HRH1 (0.70) HRH1HRH2HRH3
SCHEMBL7248482 0.80 HRH2 (1.00) HRH1HRH2HRH3
SCHEMBL7244202 0.78 HRH2 (1.00) HRH1HRH2
SCHEMBL7248942 0.77 HRH3 (0.65) HRH1HRH2HRH3

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