SCHEMBL4498985

SCHEMBL4498985

COC(=O)CCNc1cccc(S(=O)(=O)Nc2nc3ccccc3nc2Nc2cc(OC)ccc2Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 14/20 0.69
PIK3CD O00329 4/20 0.69
PIK3CA P42336 1/20 0.69
PIK3CB P42338 1/20 0.69
PRKDC P78527 1/20 0.69
PIK3C3 Q8NEB9 1/20 0.69
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
PIK3C2B O00750 1/20 0.48
PIK3C2G O75747 1/20 0.48

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
SCHEMBL189569 0.88 PIK3CG (0.73) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL16029977 0.87 PIK3CG (0.61) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL190128 0.87 PIK3CG (0.61) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL16154578 0.85 PIK3CG (0.88) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL188828 0.84 PIK3CG (0.78) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL189691 0.84 PIK3CG (0.74) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL189399 0.83 PIK3CG (0.69) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL189522 0.83 PIK3CG (0.77) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL188188 0.83 PIK3CG (0.71) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL189045 0.82 PIK3CG (0.72) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC

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-2056829-A2 USING PI3K AND MEK MODULATORS IN TREATMENTS OF CANCER Exelixis, Inc. (US) 2009-05-13 EP disclosed
WO-2008021389-A2 USING PI3K AND MEK MODULATORS IN TREATMENTS OF CANCER EXELIXIS, INC. (US) 2008-02-21 WO disclosed