SCHEMBL3410302

SCHEMBL3410302

COCCNS(=O)(=O)c1cc(-c2cnc(N)c(C(=O)c3cccnc3)n2)c(F)cc1F

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCNE2 O96020 5/20 0.53
CCNE1 P24864 5/20 0.53
CDK2 P24941 5/20 0.53
GSK3B P49841 5/20 0.53
PIK3CD O00329 2/20 0.47
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
ATR Q13535 8/20 0.40
POLB P06746 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PIK3CG P48736 1/20 0.39

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
SCHEMBL3409526 0.85 PIK3CD (0.47) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL11992025 0.82 PIK3CD (0.50) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL3409068 0.82 PIK3CD (0.70) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL3410562 0.82 CCNE2 (0.56) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL3409202 0.81 CCNE2 (0.63) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL14981242 0.80 PIK3CD (0.49) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL11992031 0.80 PIK3CD (0.49) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL12342748 0.80 PIK3CD (0.49) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL3411911 0.80 PIK3CD (0.49) CCNE2CCNE1CDK2GSK3BPIK3CD
SCHEMBL3404644 0.77 GSK3B (0.60) CCNE2CCNE1CDK2GSK3BPIK3CD

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268834-B2 Pyrazine derivatives that inhibit phosphatidylinositol 3-kinase enzyme NOVARTIS AG (CH) 2012-09-18 US claimed
EP-2257529-A2 PYRIDINES AND PYRAZINES AS INHIBITORS OF PI3K Novartis AG (CH) 2010-12-08 EP claimed
WO-2009115517-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-24 WO claimed
US-20090239847-A1 Organic compounds NOVARTIS AG (CH) 2009-09-24 US claimed
EP-3134396-B1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2019-09-18 EP disclosed
US-10004732-B2 Amino pyrazine derivatives as phosphatidylinositol 3-kinase inhibitors NOVARTIS AG (CH) 2018-06-26 US disclosed
US-10004732-B2 Amino pyrazine derivatives as phosphatidylinositol 3-kinase inhibitors NOVARTIS AG (CH) 2018-06-26 US disclosed
US-20170042889-A1 AMINO PYRAZINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2017-02-16 US disclosed
US-20170042889-A1 AMINO PYRAZINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2017-02-16 US disclosed
US-20170037032-A1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2017-02-09 US disclosed
US-20170037032-A1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2017-02-09 US disclosed
US-8846687-B2 Pyrazine compounds as PI3 kinase inhibitors NOVARTIS AG (CH) 2014-09-30 US disclosed
US-20120214800-A1 Organic Compounds NOVARTIS AG (CH) 2012-08-23 US disclosed
US-20120214800-A1 Organic Compounds NOVARTIS AG (CH) 2012-08-23 US disclosed
EP-2257529-A2 PYRIDINES AND PYRAZINES AS INHIBITORS OF PI3K Novartis AG (CH) 2010-12-08 EP disclosed
WO-2009115517-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-24 WO disclosed
WO-2009115517-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-09-24 WO disclosed
US-20090239847-A1 Organic compounds NOVARTIS AG (CH) 2009-09-24 US disclosed
US-20090239847-A1 Organic compounds NOVARTIS AG (CH) 2009-09-24 US disclosed
US-20090239847-A1 Organic compounds NOVARTIS AG (CH) 2009-09-24 US 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 (5 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-20170037032-A1 AMINO PYRIDINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PI4KA, PIP4K2B, PHKG1 CCNE2 2657/4885CCNE1 1459/4885CDK2 194/4885
US-20090239847-A1 Organic compounds AR, TRPA1, IL33 CCNE2 2451/4885CCNE1 2616/4885CDK2 3662/4885
US-10004732-B2 Amino pyrazine derivatives as phosphatidylinositol 3-kinase inhibitors PI4KA, PIP5K1B, PIP4K2B CCNE2 2400/4885CCNE1 1310/4885CDK2 137/4885
US-20170042889-A1 AMINO PYRAZINE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PI4KA, PIP5K1B, PIP4K2B CCNE2 2400/4885CCNE1 1310/4885CDK2 137/4885
US-20120214800-A1 Organic Compounds AR, TRPA1, IL33 CCNE2 2451/4885CCNE1 2616/4885CDK2 3662/4885

“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.