SCHEMBL2279149

SCHEMBL2279149

COc1ccc(C)c(Nc2nc3ccccc3nc2NS(=O)(=O)c2cccc(NCC(=O)N(C)C)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 13/20 0.60
PIK3CD O00329 5/20 0.56
PIK3CA P42336 1/20 0.56
PIK3CB P42338 1/20 0.56
PRKDC P78527 1/20 0.56
PIK3C3 Q8NEB9 1/20 0.56
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
MAPT P10636 1/20 0.50

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
SCHEMBL2277777 0.89 PIK3CD (0.60) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL188534 0.87 PIK3CG (0.78) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL2276298 0.85 PIK3CG (0.53) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL13452172 0.84 PIK3CG (0.66) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL13452357 0.83 PIK3CG (0.67) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL185593 0.81 PIK3CG (0.70) PIK3CGPIK3CDPIK3CAPIK3CBMEN1
SCHEMBL13452197 0.81 PIK3CG (0.83) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL189569 0.81 PIK3CG (0.73) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL13452363 0.81 PIK3CG (0.62) PIK3CGPIK3CDPIK3CAPIK3CBPRKDC
SCHEMBL2282396 0.81 MEN1 (0.67) 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
US-20110207712-A1 Phosphatidylinositol 3-Kinase Inhibitors And Methods Of Their Use EXELIXIS, INC. (US) 2011-08-25 US claimed
EP-2364974-A1 N-(3-Phenylamino-quinoxalin-2-yl)-benzenesulfonamide derivatives as phosphatidylinositol 3-kinase inhibitors Exelixis, Inc. (US) 2011-09-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110207712-A1 Phosphatidylinositol 3-Kinase Inhibitors And Methods Of Their Use PIK3CA, PIK3CB, PIK3CG PIK3CG 3/4885PIK3CD 4/4885PIK3CA 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.