SCHEMBL4784378

SCHEMBL4784378

CCCCCNC(=O)Nc1ccc(OC)c(Oc2ccc(NC(=O)c3cccc(OC4CCN(C(C)C)CC4)c3)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC5A7 Q9GZV3 8/20 0.45
CYP2D6 P10635 1/20 0.43
PDE4A P27815 1/20 0.42
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
MCHR1 Q99705 2/20 0.42
MCHR2 Q969V1 1/20 0.42
CCR3 P51677 1/20 0.41
QPCT Q16769 2/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL4688677 0.93 HRH3 (0.48) SLC5A7CYP2D6RAB9AQPCT
SCHEMBL4683166 0.90 HRH3 (0.48) SLC5A7CYP2D6
SCHEMBL4687069 0.90 HRH3 (0.48) SLC5A7CYP2D6
SCHEMBL4232714 0.88 SLC5A7 (0.45) SLC5A7CYP2D6MCHR1
SCHEMBL4684561 0.87 SLC5A7 (0.44) SLC5A7PDE4ARAB9ANPC1
SCHEMBL4683735 0.84 QPCT (0.43) SLC5A7PDE4ARAB9ANPC1MCHR1
SCHEMBL4682983 0.83 HRH3 (0.56) CCR3
SCHEMBL4687209 0.80 HRH3 (0.41) RAB9ACCR3QPCT
SCHEMBL4234320 0.80 HRH3 (0.48) SLC5A7CYP2D6RAB9ANPC1
SCHEMBL4688728 0.79 MCHR1 (0.47) SLC5A7CYP2D6RAB9AMCHR1MCHR2

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
EP-1879887-A2 NPY ANTAGONISTS, PREPARATION AND USE Cerep (FR) 2008-01-23 EP disclosed
WO-2006108965-A2 NPY ANTAGONISTS, PREPARATION AND USE CEREP (FR) 2006-10-19 WO disclosed