SCHEMBL2332308

SCHEMBL2332308

O=C(O)NC1CCN(c2cnc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.57
PDE10A Q9Y233 2/20 0.48
CKS1B P61024 5/20 0.47
SKP1 P63208 5/20 0.47
SKP2 Q13309 5/20 0.47
PTGES O14684 4/20 0.43
HCAR2 Q8TDS4 2/20 0.43
PTGS2 P35354 1/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
JAK3 P52333 2/20 0.43

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
SCHEMBL2331480 0.83 HRH4 (0.54) HRH4PDE10ACKS1BSKP1SKP2
SCHEMBL2331484 0.80 HRH4 (0.58) HRH4PDE10AHCAR2KDM4ENPC1
SCHEMBL2006084 0.79 DEGS1 (0.51) CKS1BSKP1SKP2KDM4EMAPT
SCHEMBL21855943 0.78 CKS1B (0.44) CKS1BSKP1SKP2HCAR2JAK3
SCHEMBL21855939 0.78 CKS1B (0.44) CKS1BSKP1SKP2HCAR2JAK3
SCHEMBL2360815 0.73 HRH4 (0.53) HRH4PDE10AHCAR2KDM4ENPC1
SCHEMBL10219394 0.73 HRH4 (0.70) HRH4PDE10AKDM4ENPC1MAPT
SCHEMBL607451 0.73 HRH4 (1.00) HRH4KDM4ENPC1MAPTRAB9A
SCHEMBL4334757 0.73 TRPV1 (0.51) CKS1BSKP1SKP2
SCHEMBL27629095 0.73 PDE10A (0.53) HRH4PDE10AKDM4EMAPT

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