SCHEMBL2279835

SCHEMBL2279835

COc1ccc(C)c(Nc2nc3ncccc3nc2NS(=O)(=O)c2cccc(N)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 4/20 0.70
PIK3C2B O00750 1/20 0.52
PIK3C2G O75747 1/20 0.52
PIK3CG P48736 12/20 0.51
MAPT P10636 3/20 0.50
PIK3CA P42336 1/20 0.49
PIK3CB P42338 1/20 0.49
PRKDC P78527 1/20 0.49
PIK3C3 Q8NEB9 1/20 0.49
GLO1 Q04760 1/20 0.46
SLC40A1 Q9NP59 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL2281179 1.00 PIK3CD (0.70) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL2278792 0.91 PIK3CD (0.68) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL2277524 0.91 PIK3CD (0.68) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL189291 0.91 PIK3CD (0.62) PIK3CDPIK3CGMAPTPIK3CAPIK3CB
SCHEMBL2276250 0.88 PIK3CD (0.68) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL2283949 0.88 PIK3CD (0.68) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL188933 0.87 PIK3C2B (0.69) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL188796 0.87 PIK3C2B (0.69) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL12653106 0.83 PIK3C2B (0.61) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT
SCHEMBL2307066 0.82 PIK3CD (1.00) PIK3CDPIK3C2BPIK3C2GPIK3CGMAPT

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 3 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
US-20100087440-A1 Phosphatidylinositol 3-Kinase Inhibitors and Methods of Their Use EXELIXIS, INC. 2010-04-08 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 (2 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-20100087440-A1 Phosphatidylinositol 3-Kinase Inhibitors and Methods of Their Use PIK3CA, PIK3CB, PIK3CG PIK3CD 4/4885PIK3C2B 7/4885PIK3C2G 29/4885
US-20110207712-A1 Phosphatidylinositol 3-Kinase Inhibitors And Methods Of Their Use PIK3CA, PIK3CB, PIK3CG PIK3CD 4/4885PIK3C2B 7/4885PIK3C2G 29/4885

“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.