SCHEMBL1730192

SCHEMBL1730192

CNC(=O)CN(CCC1CCN(c2cnc3ccccc3n2)CC1)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CKS1B P61024 12/20 0.46
SKP1 P63208 12/20 0.46
SKP2 Q13309 12/20 0.46
HCAR2 Q8TDS4 2/20 0.46
ACACB O00763 1/20 0.42
ACACA Q13085 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HTR3A P46098 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
NFKB1 P19838 1/20 0.42
HTT P42858 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PDE10A Q9Y233 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
SCHEMBL1728883 0.89 MAP4K4 (0.44) CKS1BSKP1SKP2ACACBACACA
SCHEMBL1728164 0.88 KDM4E (0.45) HCAR2ACACBACACAHTR3AHRH4
SCHEMBL1729037 0.87 HCAR2 (0.46) CKS1BSKP1SKP2HCAR2ACACB
SCHEMBL1730124 0.86 CHRM4 (0.46) CKS1BSKP1SKP2HTR3A
SCHEMBL1729260 0.85 HTR3A (0.42) CKS1BSKP1SKP2ACACBACACA
SCHEMBL1727922 0.84 DRD2 (0.46) ALDH1A1HPGDSMN1; SMN2
SCHEMBL1727890 0.82 HTR1A (0.40) ACACBACACAMAPTPDE10A
SCHEMBL1727647 0.82 MAP4K4 (0.40) CKS1BSKP1SKP2ACACBACACA
SCHEMBL1727727 0.82 MAP4K4 (0.40) CKS1BSKP1SKP2ACACB
SCHEMBL1728683 0.81 DRD3 (0.40) CKS1BSKP1SKP2ACACBACACA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1633735-B1 DERIVATIVES OF PIPERIDINYL- AND PIPERAZINYL-ALKYL CARBAMATES, PREPARATION METHODS THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI SA (FR) 2011-11-30 EP claimed