SCHEMBL2331480

SCHEMBL2331480

O=C(O)NCC1CCN(c2cnc3cc(Cl)ccc3n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.54
PDE10A Q9Y233 2/20 0.53
CKS1B P61024 13/20 0.49
SKP1 P63208 13/20 0.49
SKP2 Q13309 13/20 0.49
P2RX7 Q99572 1/20 0.43
DGAT1 O75907 1/20 0.43
KCNH2 Q12809 1/20 0.43
BACE1 P56817 1/20 0.42

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
SCHEMBL1728851 0.84 HRH3 (0.58) HRH4PDE10AP2RX7DGAT1KCNH2
SCHEMBL2332308 0.83 HRH4 (0.57) HRH4PDE10ACKS1BSKP1SKP2
SCHEMBL1727907 0.80 DEGS1 (0.56) PDE10ACKS1BSKP1SKP2
SCHEMBL2360815 0.77 HRH4 (0.53) HRH4PDE10ADGAT1KCNH2
SCHEMBL2331484 0.77 HRH4 (0.58) HRH4PDE10ADGAT1KCNH2BACE1
SCHEMBL26969339 0.77 PTGES (0.63)
SCHEMBL2331847 0.76 HRH4 (0.52) HRH4PDE10ADGAT1KCNH2
SCHEMBL1728774 0.75 HRH3 (0.55) PDE10ADGAT1KCNH2
SCHEMBL3650734 0.75 F10 (0.51) HRH4CKS1BSKP1SKP2P2RX7
SCHEMBL1728004 0.74 HCAR2 (0.53) HRH4PDE10ACKS1BSKP1SKP2

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