SCHEMBL8205332

SCHEMBL8205332

CCNC(=O)Nc1ccc(-c2nc(N)cc(C(C)(C)S(=O)(=O)c3cc(F)cc(F)c3)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 7/20 0.48
PIK3CA P42336 6/20 0.48
MTOR P42345 6/20 0.43
PIK3CG P48736 1/20 0.43
NAMPT P43490 4/20 0.40
GHSR Q92847 1/20 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
SCHEMBL8205299 0.93 PIK3CD (0.48) PIK3CDPIK3CAMTORPIK3CGNAMPT
SCHEMBL8217617 0.91 PIK3CA (0.41) PIK3CDPIK3CAMTORNAMPT
SCHEMBL8205334 0.89 PIK3CA (0.41) PIK3CDPIK3CAMTORPIK3CGNAMPT
SCHEMBL8214019 0.88 ATM (0.45) PIK3CDPIK3CAMTORPIK3CG
SCHEMBL11925811 0.87 KIF11 (0.44) PIK3CDPIK3CAMTOR
SCHEMBL8213062 0.87 PIK3CD (0.49) PIK3CDPIK3CAMTORPIK3CGNAMPT
SCHEMBL8214526 0.86 PIK3CD (0.61) PIK3CDPIK3CAMTORPIK3CGGHSR
SCHEMBL8213348 0.85 CYP3A4 (0.40) PIK3CDPIK3CA
SCHEMBL8214017 0.84 CYP3A4 (0.43)
SCHEMBL8215290 0.84 PIK3CD (0.46) PIK3CDPIK3CAMTORPIK3CGNAMPT

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