SCHEMBL5210629

SCHEMBL5210629

CN(C)C(=O)c1cccc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)n1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 12/20 0.57
HSD11B1 P28845 4/20 0.47
OGA O60502 1/20 0.43
MAP4K4 O95819 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
OGFRL1 Q5TC84 1/20 0.41
DGAT2 Q96PD7 1/20 0.40

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
SCHEMBL5210438 0.85 HRH3 (0.60) HRH3HSD11B1OGAMAP4K4
SCHEMBL5210476 0.83 HRH3 (0.57) HRH3HSD11B1OGA
SCHEMBL5208501 0.83 HRH3 (0.58) HRH3HSD11B1
SCHEMBL5210164 0.80 HRH3 (0.55) HRH3
SCHEMBL5211791 0.78 HRH3 (0.59) HRH3
SCHEMBL5211397 0.78 HRH3 (0.57) HRH3
Hydrochloric Acid SCHEMBL5210768 0.77 HRH3 (0.56) HRH3
SCHEMBL5209775 0.76 HRH3 (0.53) HRH3
SCHEMBL14843580 0.73 HRH3 (1.00) HRH3
SCHEMBL5209685 0.70 HRH3 (0.75) HRH3

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-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP claimed