SCHEMBL8217170

SCHEMBL8217170

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

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 9/20 0.42
MTOR P42345 9/20 0.42
PIK3CD O00329 6/20 0.42
PIK3CG P48736 1/20 0.40
PIP4K2A P48426 1/20 0.39
PIP4K2B P78356 1/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL8212644 0.91 PIK3CA (0.42) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8219487 0.86 PIK3CA (0.40) PIK3CAMTORPIK3CDKMT2AALDH1A1
SCHEMBL8218964 0.84 PIK3CA (0.42) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL11926849 0.83 PIK3CA (0.42) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8213870 0.83 PIK3CA (0.43) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8214197 0.82 PIK3CA (0.42) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8216966 0.82 MTOR (0.40) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8214615 0.81 KMT2A (0.49) PIK3CAMTORPIK3CDPIK3CGKMT2A
SCHEMBL8212679 0.81 PIK3CA (0.47) PIK3CAMTORPIK3CDPIK3CGPIP4K2A
SCHEMBL8216392 0.81 KMT2A (0.46) PIK3CAMTORPIK3CDPIK3CGPIP4K2A

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-2008023159-A1 MORPHOLINO PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2008-02-28 WO disclosed