SCHEMBL10077166

SCHEMBL10077166

CC(C)(C)OC(=O)NCCN(CC=O)C(=O)Cn1cnc2c(N)nc(NC(=O)CCN)nc21

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 0.36
ADORA1 P30542 7/20 0.36
ADORA3 P0DMS8 5/20 0.36
DOT1L Q8TEK3 1/20 0.33
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 1/20 0.33
TLR7 Q9NYK1 4/20 0.33
ADORA2B P29275 2/20 0.32
ABL1 P00519 1/20 0.32
PDGFRB P09619 1/20 0.32
SRC P12931 1/20 0.32
PDGFRA P16234 1/20 0.32
MAPK14 Q16539 1/20 0.32
CSNK1D P48730 1/20 0.32
TMIGD3 P0DMS9 2/20 0.32
KDM4E B2RXH2 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL13037052 0.90 TLR7 (0.36) ADORA2AADORA1ADORA3DOT1LCKS1B
SCHEMBL10076893 0.80 CDK2 (0.34) DOT1LCKS1BSKP1SKP2CSNK1D
SCHEMBL13074135 0.80 CKS1B (0.34) ADORA2AADORA1ADORA3DOT1LCKS1B
SCHEMBL23892831 0.80 HPRT1 (0.43)
SCHEMBL10077170 0.78 CCNE2 (0.35) DOT1LCKS1BSKP1SKP2TLR7
SCHEMBL13074313 0.78 CCNE2 (0.36) DOT1LCKS1BSKP1SKP2TLR7
SCHEMBL10077165 0.77 HDAC1 (0.36) CKS1BSKP1SKP2
SCHEMBL10077177 0.76 CCNE1 (0.40) DOT1LCKS1BSKP1SKP2CSNK1D
SCHEMBL10078207 0.75 CKS1B (0.34) ADORA1CKS1BSKP1SKP2TLR7
SCHEMBL10078094 0.74 MEN1 (0.34) ADORA1CKS1BSKP1SKP2KDM4E

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
WO-2012011114-A2 SEQUENCE SPECIFIC DOUBLE-STRANDED DNA/RNA BINDING COMPOUNDS AND USES THEREOF GENEARREST LTD (IL) 2012-01-26 WO disclosed