SCHEMBL8206506

SCHEMBL8206506

CNC(=O)Nc1ccc(-c2nc(N)cc(CS(=O)(=O)c3ccncc3)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.45
HTT P42858 1/20 0.45
MCL1 Q07820 1/20 0.45
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PIK3CA P42336 5/20 0.41
MTOR P42345 4/20 0.41
PIK3CD O00329 4/20 0.41
PIP4K2A P48426 1/20 0.41
PIP4K2B P78356 1/20 0.41
NAMPT P43490 4/20 0.41
PIK3CG P48736 1/20 0.39
MAPT P10636 2/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL8212662 0.91 KMT2A (0.44) HTTKMT2AMEN1PIK3CAMTOR
SCHEMBL8216392 0.91 KMT2A (0.46) POLBKMT2AMEN1PIK3CAMTOR
SCHEMBL8214615 0.91 KMT2A (0.49) POLBHTTMCL1KMT2AMEN1
SCHEMBL8218182 0.89 PIK3CA (0.51) KMT2AMEN1PIK3CAMTORPIK3CD
SCHEMBL8217167 0.83 PIK3CA (0.40) KMT2AMEN1L3MBTL1PIK3CAMTOR
SCHEMBL8218954 0.82 NAMPT (0.53) PIK3CAPIK3CDNAMPT
SCHEMBL8213870 0.82 PIK3CA (0.43) KMT2AMEN1PIK3CAMTORPIK3CD
SCHEMBL8212650 0.82 PIK3CA (0.42) KMT2AMEN1PIK3CAMTORPIK3CD
SCHEMBL8212644 0.81 PIK3CA (0.42) KMT2AMEN1PIK3CAMTORPIK3CD
SCHEMBL8218964 0.81 PIK3CA (0.42) KMT2AMEN1PIK3CAMTORPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057140-B1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2012-08-08 EP disclosed
WO-2008023159-A1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2008-02-28 WO disclosed