SCHEMBL28675760

SCHEMBL28675760

COc1ncnc2c1CN(C1CCOCC1)C(=O)N2C

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 3/20 0.33
PIK3CA P42336 11/20 0.33
PIK3CD O00329 8/20 0.33
PIK3CB P42338 2/20 0.33
PIK3CG P48736 2/20 0.33
JAK2 O60674 1/20 0.32
LRRK2 Q5S007 1/20 0.32
CTSE P14091 1/20 0.32
BACE1 P56817 1/20 0.32
PDE10A Q9Y233 2/20 0.31
CYP2C19 P33261 1/20 0.31
CCNE2 O96020 1/20 0.31
CCNE1 P24864 1/20 0.31
CDK2 P24941 1/20 0.31
MTOR P42345 1/20 0.31

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
SCHEMBL28660356 0.83 PRKDC (0.34) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL28655766 0.77 PIK3CA (0.35) PIK3CAPIK3CDPIK3CBPIK3CGLRRK2
SCHEMBL30853317 0.68 FGFR4 (0.44) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL27186898 0.68 CNR2 (0.36) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL14374406 0.68 PRKDC (0.39) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL30030718 0.58 PRKDC (0.57) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL6844511 0.58 PRKDC (0.57) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL13545318 0.58 PRKDC (0.33) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL30031644 0.58 PRKDC (0.48) PRKDCPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17623866 0.57 PDPK1 (0.38) PIK3CAPIK3CDBACE1

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
CN-113727758-A Bicyclic heterocyclic compounds and use thereof 锐新医药公司 2021-11-30 CN disclosed