SCHEMBL4619663

SCHEMBL4619663

CCCN(C)C(=O)c1ccc(OCCCN2CC3CCCC3C2)cc1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.65
HRH1 P35367 5/20 0.50
DRD3 P35462 1/20 0.50
HRH2 P25021 4/20 0.46
MAOB P27338 1/20 0.46
DRD2 P14416 1/20 0.45

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
Oxalic Acid SCHEMBL4501979 0.97 HRH3 (0.61) HRH3HRH1DRD3HRH2
SCHEMBL4622461 0.91 HRH3 (0.67) HRH3HRH1DRD3HRH2MAOB
SCHEMBL4621699 0.90 HRH3 (0.66) HRH3HRH1HRH2MAOB
Oxalic Acid SCHEMBL4504804 0.88 HRH3 (0.64) HRH3HRH1DRD3
SCHEMBL4489369 0.88 HRH3 (0.72) HRH3HRH1HRH2MAOB
Oxalic Acid SCHEMBL4496330 0.87 HRH3 (0.62) HRH3HRH1HRH2
SCHEMBL4620858 0.85 HRH3 (0.69) HRH3HRH1HRH2MAOB
SCHEMBL4493848 0.85 HRH3 (0.68) HRH3HRH1HRH2MAOB
SCHEMBL4621749 0.84 HRH3 (0.69) HRH3HRH1HRH2MAOB
Oxalic Acid SCHEMBL4485952 0.84 HRH3 (0.67) HRH3HRH1HRH2MAOB

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
EP-1720544-B1 NOVEL AZABICYCLIC DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SERVIER LAB (FR) 2008-03-19 EP disclosed