SCHEMBL1891980

SCHEMBL1891980

CCc1cnc(CCNC(=O)Nc2nc(C)c(-c3ccnc(Cl)c3)s2)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 15/20 0.41
PIK3CD O00329 12/20 0.41
PIK3CA P42336 10/20 0.41
PIK3CB P42338 10/20 0.41
PI4KB Q9UBF8 6/20 0.41
CLK2 P49760 2/20 0.41
CLK1 P49759 1/20 0.41
PIK3C3 Q8NEB9 2/20 0.40
PIK3C2A O00443 1/20 0.40
PIK3C2B O00750 1/20 0.40
PI4KA P42356 1/20 0.40
PRKDC P78527 1/20 0.40
DYRK3 O43781 1/20 0.39
MAP4K4 O95819 1/20 0.39
DYRK1A Q13627 1/20 0.39
MINK1 Q8N4C8 1/20 0.39
CLK4 Q9HAZ1 1/20 0.39
CYP3A4 P08684 1/20 0.38
MAPK14 Q16539 1/20 0.37
SMARCA2 P51531 1/20 0.37

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
SCHEMBL1885418 0.88 PIK3CG (0.44) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1883366 0.86 PIK3CG (0.41) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL48706 0.81 PIK3CD (0.65) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1886455 0.81 PIK3CG (0.40) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1890711 0.80 PIK3CG (0.40) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL2321626 0.80 PIK3CG (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1784942 0.79 PIK3CD (0.60) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1887132 0.79 PIK3CG (0.46) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL1883179 0.78 PIK3CG (0.50) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB
SCHEMBL5782116 0.78 PIK3CD (0.48) PIK3CGPIK3CDPIK3CAPIK3CBPI4KB

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157091-B1 Inhibitors of phosphatidylinositol 3-kinase NOVARTIS AG (CH) 2015-06-10 EP disclosed
US-20130172349-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE NOVARTIS AG (CH) 2013-07-04 US disclosed
US-8404684-B2 Inhibitors of phosphatidylinositol 3-kinase NOVARTIS AG (CH) 2013-03-26 US disclosed
US-20110105535-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE NOVARTIS AG 2011-05-05 US disclosed
CN-1816549-B Phosphatidylinositol 3-kinase inhibitors NOVARTIS AG 2010-09-29 CN disclosed
EP-2157091-A1 Inhibitors of phosphatidylinositol 3-kinase Novartis AG (CH) 2010-02-24 EP disclosed
CN-101648949-A inhibitors of phosphatidylinositol 3-kinase NOVARTIS AG CH 2010-02-17 CN disclosed
EP-1622897-B1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE NOVARTIS AG (CH) 2009-10-14 EP disclosed
US-20070032487-A1 Inhibitors of phosphatidylinositol 3-kinase NOVARTIS AG (CH) 2007-02-08 US disclosed
CN-1816549-A Phosphatidylinositol 3-kinase inhibitors NOVARTIS AG (CH) 2006-08-09 CN disclosed
EP-1622897-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE Novartis AG (CH) 2006-02-08 EP disclosed
WO-2004096797-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE NOVARTIS AG (CH) 2004-11-11 WO 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 (3 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-20070032487-A1 Inhibitors of phosphatidylinositol 3-kinase PIK3CA, PIP4K2C, PIP4K2B PIK3CG 10/4885PIK3CD 4/4885PIK3CA 1/4885
US-20110105535-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE PIK3CA, PIK3CD, PIP4K2C PIK3CG 8/4885PIK3CD 2/4885PIK3CA 1/4885
US-20130172349-A1 INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE PIK3CA, PIK3CD, PIP4K2C PIK3CG 8/4885PIK3CD 2/4885PIK3CA 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.