SCHEMBL2331847

SCHEMBL2331847

CCC1(CCNC(=O)O)CCN(c2cnc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.52
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 1/20 0.42
PTPN11 Q06124 1/20 0.39
PDE10A Q9Y233 1/20 0.39
CNR1 P21554 4/20 0.39
HCRTR1 O43613 3/20 0.39
HCRTR2 O43614 3/20 0.39
MAPT P10636 2/20 0.38
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
DGAT1 O75907 1/20 0.37
KCNH2 Q12809 1/20 0.37
MCHR1 Q99705 3/20 0.37
HCAR2 Q8TDS4 1/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL2324589 0.91 HRH4 (0.48) HRH4PPARGPPARDPPARAPTPN11
SCHEMBL2360815 0.89 HRH4 (0.53) HRH4PTPN11PDE10ACNR1HCRTR1
SCHEMBL2331480 0.76 HRH4 (0.54) HRH4PDE10ADGAT1KCNH2
SCHEMBL2331854 0.76 HRH4 (0.54) HRH4PPARDPTPN11PDE10ACNR1
SCHEMBL345259 0.75 HRH4 (0.40) HRH4PPARGPPARDPPARAPTPN11
SCHEMBL2332308 0.73 HRH4 (0.57) HRH4PDE10AMAPTKDM4ENPC1
SCHEMBL2324599 0.71 HRH4 (0.50) HRH4PPARGPPARDPTPN11PDE10A
SCHEMBL607451 0.70 HRH4 (1.00) HRH4MAPTKDM4ENPC1RAB9A
SCHEMBL2331484 0.69 HRH4 (0.58) HRH4PDE10AMAPTKDM4ENPC1
SCHEMBL2324230 0.68 ADRB1 (0.46) MAPTKDM4EKCNH2

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 4 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
US-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US 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