SCHEMBL2331484

SCHEMBL2331484

CN(C(=O)O)C1CCN(c2cnc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 3/20 0.58
PDE10A Q9Y233 2/20 0.47
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
DGAT1 O75907 3/20 0.40
KCNH2 Q12809 3/20 0.40
ADORA2A P29274 2/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
F10 P00742 4/20 0.40
HCAR2 Q8TDS4 1/20 0.40
BACE1 P56817 1/20 0.39
F2 P00734 1/20 0.39
PLAT P00750 1/20 0.39
KLKB1 P03952 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
JAK3 P52333 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL2332308 0.80 HRH4 (0.57) HRH4PDE10AKDM4ENPC1MAPT
SCHEMBL21856029 0.79 MAPK3 (0.41) HRH4KDM4EHCAR2BACE1JAK3
SCHEMBL21856032 0.79 MAPK3 (0.41) HRH4KDM4EHCAR2BACE1JAK3
SCHEMBL2331480 0.77 HRH4 (0.54) HRH4PDE10ADGAT1KCNH2BACE1
SCHEMBL2331854 0.77 HRH4 (0.54) HRH4PDE10AKDM4ENPC1MAPT
SCHEMBL344750 0.76 HRH4 (0.43) HRH4PDE10ANPC1MAPTRAB9A
SCHEMBL607451 0.74 HRH4 (1.00) HRH4KDM4ENPC1MAPTRAB9A
SCHEMBL3650736 0.74 TRPV1 (0.46) HRH4HRH3JAK3
SCHEMBL2324599 0.74 HRH4 (0.50) HRH4PDE10AKDM4ENPC1MAPT
SCHEMBL14485331 0.73 NPY5R (0.58) F10ALDH1A1HTTSMN1; SMN2

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-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP disclosed
EP-2356108-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-08-17 EP disclosed
WO-2010055267-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-05-20 WO disclosed