SCHEMBL8212604

SCHEMBL8212604

CCNC(=O)Nc1ccc(-c2nc(N)cc(CS(=O)(=O)c3ccccc3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.53
PIK3CA P42336 3/20 0.53
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
MAPT P10636 4/20 0.47
MCOLN3 Q8TDD5 1/20 0.47
NPSR1 Q6W5P4 3/20 0.46
HTT P42858 2/20 0.46
RORC P51449 1/20 0.46
MTOR P42345 1/20 0.45
PIK3CG P48736 1/20 0.45
ALDH1A1 P00352 3/20 0.44
POLB P06746 2/20 0.44
MCL1 Q07820 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
NAMPT P43490 1/20 0.42

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
SCHEMBL8213064 0.90 PIK3CD (0.51) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8219760 0.90 PIK3CA (0.51) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8214615 0.90 KMT2A (0.49) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8217106 0.88 BDKRB1 (0.47) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8212562 0.88 PIK3CA (0.53) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8214218 0.87 PIK3CA (0.66) PIK3CDPIK3CAMTORPIK3CG
SCHEMBL8212559 0.84 MEN1 (0.46) PIK3CDPIK3CAMEN1KMT2AMAPT
SCHEMBL8213164 0.84 PIK3CA (0.55) PIK3CDPIK3CAMTORPIK3CG
SCHEMBL8211601 0.83 PIK3CA (0.48) PIK3CDPIK3CAMEN1KMT2ARORC
SCHEMBL8205071 0.82 PIK3CA (0.54) PIK3CDPIK3CAMEN1KMT2AMAPT

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