SCHEMBL8222525

SCHEMBL8222525

CC(C)(c1cc(N)nc(-c2ccc(NC(=O)Nc3ccon3)cc2)n1)S(C)(=O)=O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.48
POLB P06746 1/20 0.48
NPC1 O15118 1/20 0.46
PIK3CD O00329 9/20 0.45
PIK3CA P42336 7/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
MTOR P42345 1/20 0.43
KDR P35968 2/20 0.40

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
SCHEMBL8218768 0.86 ALDH1A1 (0.51) RAB9ANPC1PIK3CDPIK3CAKMT2A
SCHEMBL8214220 0.84 PIK3CA (0.48) PIK3CDPIK3CAKMT2AMEN1MTOR
SCHEMBL11926097 0.83 RAB9A (0.43) RAB9APOLBNPC1PIK3CDPIK3CA
SCHEMBL8213175 0.82 PIK3CA (0.51) RAB9APOLBNPC1PIK3CDPIK3CA
SCHEMBL8206578 0.81 PIK3CD (0.46) PIK3CDPIK3CAKMT2AMEN1
SCHEMBL8214526 0.81 PIK3CD (0.61) PIK3CDPIK3CAMTOR
SCHEMBL8213776 0.81 CA12 (0.48) PIK3CDPIK3CA
SCHEMBL8090195 0.79 RAB9A (0.47) RAB9APOLBNPC1PIK3CDPIK3CA
SCHEMBL8216529 0.79 PIK3CD (0.53) PIK3CDPIK3CAKMT2AMEN1MTOR
SCHEMBL3603215 0.79 PIK3CA (0.75) PIK3CDPIK3CAMTOR

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