SCHEMBL4680197

SCHEMBL4680197

c1ncc(CC[N]CC2CC2)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 14/20 0.51
HRH4 Q9H3N8 6/20 0.47
HTR3A P46098 1/20 0.47
HRH2 P25021 3/20 0.46
LMNA P02545 1/20 0.46
MIF P14174 1/20 0.46
TSHR P16473 1/20 0.46
HRH1 P35367 1/20 0.46
APEX1 P27695 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL4681304 0.83 HRH4 (0.50) HRH3HRH4HTR3A
SCHEMBL22701433 0.77 HRH3 (0.80) HRH3HRH4HTR3AHRH2LMNA
SCHEMBL8963903 0.71 HRH3 (0.73) HRH3HRH4HRH2LMNAMIF
SCHEMBL4680200 0.70 HRH3 (0.56) HRH3HRH4
SCHEMBL21594260 0.68 HRH3 (0.52) HRH3HRH4HRH2LMNAMIF
SCHEMBL8963886 0.67 HRH3 (0.75) HRH3HRH4HRH2LMNAMIF
SCHEMBL8964986 0.67 HRH3 (0.79) HRH3HRH4HRH2HRH1
SCHEMBL29462302 0.66 HRH3 (1.00) HRH3HRH4
SCHEMBL4681311 0.66 CXCR4 (0.57) HRH3HRH4HTR3A
SCHEMBL890317 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B8 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-08-27 EP disclosed
EP-1416933-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR Amgem, Inc. (US) 2004-05-12 EP disclosed
WO-2003009847-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM, INC. (US) 2003-02-06 WO disclosed