SCHEMBL15049941

SCHEMBL15049941

COc1ncc(-c2cc(-c3ncc(CN4CC(C)OC(C)C4)o3)c3cnn(S(=O)(=O)c4ccccc4)c3c2)cc1NS(C)(=O)=O

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 0.67
PIK3CA P42336 11/20 0.67
PIK3CG P48736 11/20 0.67
PIK3CB P42338 10/20 0.67
PIK3R2 O00459 1/20 0.67
PIK3R1 P27986 8/20 0.47
PI4KA P42356 1/20 0.36

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
SCHEMBL458224 1.00 PIK3CD (0.67) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL15069989 0.91 PIK3CD (0.55) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL470063 0.90 PIK3CD (0.54) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL661037 0.90 PIK3CA (0.57) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL463381 0.90 PIK3CA (0.57) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL21087321 0.83 PIK3CA (0.49) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL457631 0.82 PIK3CA (0.48) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL17255826 0.81 PIK3CA (0.48) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL173490 0.81 PIK3CD (1.00) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2
SCHEMBL29394358 0.81 PIK3CD (1.00) PIK3CDPIK3CAPIK3CGPIK3CBPIK3R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160237073-A1 Novel Polymorphs and Salts GLAXO GROUP LTD (GB) 2016-08-18 US disclosed
US-9353098-B2 Polymorphs and salts GLAXO GROUP LIMITED (GB) 2016-05-31 US disclosed
US-9326987-B2 Indazole derivatives for use in the treatment of influenza virus infection GLAXO GROUP LIMITED (GB) 2016-05-03 US disclosed
US-20150299177-A1 Novel Polymorphs and Salts GLAXO GROUP LIMITED (GB) 2015-10-22 US disclosed
US-9102668-B2 Polymorphs and salts GLAXO GROUP LIMITED (GB) 2015-08-11 US disclosed
EP-2614058-B1 POLYMORPHS AND SALTS OF N-[5-[4-(5-{[(2R,6S)-2,6-DIMETHYL-4-MORPHOLINYL]METHYL}-& xA;1,3-OXAZOL-2-YL)-1H-INDAZOL-6-YL]-2-(METHYLOXY)-3-PYRIDINYL]METHANESULFONAMIDE GLAXOSMITHKLINE IP DEV LTD (GB) 2015-07-08 EP disclosed
US-20140256721-A1 Novel Polymorphs and Salts GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-09-11 US disclosed
US-8735390-B2 Polymorphs and salts GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2014-05-27 US disclosed
US-20130165433-A1 Novel Use GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-06-27 US disclosed
US-20130165441-A1 Novel Polymorphs and Salts GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2013-06-27 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-20130165441-A1 Novel Polymorphs and Salts PRKDC, PRKACA, MAP3K20 PIK3CD 153/4885PIK3CA 133/4885PIK3CG 290/4885
US-20130165433-A1 Novel Use HAVCR2, MAVS, ENTPD5 PIK3CD 2938/4885PIK3CA 2691/4885PIK3CG 2718/4885
US-20160237073-A1 Novel Polymorphs and Salts PRKDC, PRKACA, MAP3K20 PIK3CD 153/4885PIK3CA 133/4885PIK3CG 290/4885
US-20150299177-A1 Novel Polymorphs and Salts PRKDC, PRKACA, MAP3K20 PIK3CD 153/4885PIK3CA 133/4885PIK3CG 290/4885
US-20140256721-A1 Novel Polymorphs and Salts PRKDC, PRKACA, MAP3K20 PIK3CD 153/4885PIK3CA 133/4885PIK3CG 290/4885

“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.