SCHEMBL1543377

SCHEMBL1543377

O=S(=O)(Nc1cc(-c2ccc3nccc(Cl)c3c2)cnc1Cl)c1ccccc1F

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 17/20 0.64
PIK3CD O00329 5/20 0.60
PIK3CB P42338 3/20 0.60
PIK3CG P48736 3/20 0.60
PIK3R1 P27986 1/20 0.60
MTOR P42345 3/20 0.58
AKT1 P31749 2/20 0.58
PIK3C3 Q8NEB9 2/20 0.56

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
SCHEMBL1543935 0.84 PIK3CA (0.77) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL1543838 0.83 PIK3CA (0.77) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL1543410 0.81 PIK3CA (0.62) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL17833772 0.78 PIK3CA (1.00) PIK3CAPIK3CDPIK3CBPIK3CGPIK3R1
SCHEMBL731496 0.78 PIK3CA (0.80) PIK3CAPIK3CDPIK3CBPIK3CGPIK3R1
SCHEMBL1543811 0.78 PIK3CA (0.58) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL1619906 0.77 AKT1 (0.82) PIK3CAPIK3CDPIK3CBPIK3CGMTOR
SCHEMBL730061 0.77 PIK3CA (0.77) PIK3CAPIK3CDPIK3CBPIK3CGPIK3R1
SCHEMBL20099777 0.77 PIK3C3 (0.73) PIK3CAPIK3CDPIK3CGMTORAKT1
SCHEMBL732310 0.76 PIK3CA (0.69) PIK3CAPIK3CDPIK3CBPIK3CGPIK3R1

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-2307400-A2 INHIBITORS OF PI3 KINASE Amgen, Inc (US) 2011-04-13 EP disclosed
WO-2009155121-A2 INHIBITORS OF PI3 KINASE AMGEN INC. (US) 2009-12-23 WO disclosed