SCHEMBL3099579

SCHEMBL3099579

CC(=O)Nc1nc(C)c(-c2ccc(C(C)=O)c(F)c2)s1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 18/20 0.69
PIK3CD O00329 16/20 0.69
PIK3CA P42336 13/20 0.69
PIK3CB P42338 13/20 0.69
PIK3C3 Q8NEB9 4/20 0.53
PIK3C2A O00443 1/20 0.50
PIK3C2B O00750 1/20 0.50
PI4KA P42356 1/20 0.50
PRKDC P78527 1/20 0.50
PI4KB Q9UBF8 1/20 0.50
PIK3R1 P27986 1/20 0.47

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
SCHEMBL48660 0.82 PIK3CG (1.00) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL13149722 0.82 PIK3CD (0.49) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL3075444 0.81 GPR52 (0.47) PIK3CGPIK3CDPIK3CAPIK3CB
SCHEMBL48831 0.81 PIK3CG (0.64) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL2324243 0.80 PIK3CD (0.73) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL48579 0.80 PIK3CG (0.83) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL12991810 0.80 PIK3CG (0.62) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL2359167 0.79 PIK3CD (0.54) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL49221 0.79 PIK3CG (0.71) PIK3CGPIK3CDPIK3CAPIK3CBPIK3C3
SCHEMBL48942 0.79 PIK3CG (1.00) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
CN-101479258-A Thiazolyl urea derivatives as phosphatidylinositol 3-kinase inhibitors NOVARTIS AG (CH) 2009-07-08 CN disclosed
EP-2035413-A2 THIAZOLYL UREA DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS Novartis AG (CH) 2009-03-18 EP disclosed
WO-2008000421-A2 THIAZOLYL UREA DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-03 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 (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-20100120865-A1 Organic compounds PIK3C3, PIK3R3, PIK3R4 PIK3CG 12/4885PIK3CD 10/4885PIK3CA 5/4885

“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.