SCHEMBL789960

SCHEMBL789960

COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1NS(=O)(=O)C1CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALPL P05186 1/20 0.48
PIK3CA P42336 9/20 0.47
MTOR P42345 2/20 0.41
ATM Q13315 1/20 0.41
ATR Q13535 1/20 0.41
PIK3CD O00329 8/20 0.38
PIK3CB P42338 1/20 0.38
PIK3CG P48736 1/20 0.38
BRAF P15056 1/20 0.37
AAK1 Q2M2I8 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
SCHEMBL31029597 0.95 ALPL (0.46) ALPLPIK3CAMTORATMATR
SCHEMBL25778307 0.93 PIK3CA (0.43) ALPLPIK3CAMTORATMATR
SCHEMBL109782 0.87 ALPL (0.52) ALPLPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL14860356 0.82 ALPL (0.53) ALPLPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL791103 0.81 ALPL (0.48) ALPLPIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL798867 0.81 ALPL (0.48) ALPLPIK3CAMTORPIK3CDPIK3CB
SCHEMBL15560975 0.79 CA1 (0.41) ALPL
SCHEMBL29556839 0.79 ALPL (0.56) ALPLPIK3CAMTORPIK3CDPIK3CB
SCHEMBL22447638 0.79 ALPL (0.49) ALPLPIK3CAMTORPIK3CDPIK3CB
SCHEMBL789687 0.79 ALPL (0.47) ALPLPIK3CAPIK3CDPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12508264-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2025-12-30 US disclosed
US-12508263-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2025-12-30 US disclosed
EP-4169917-B1 QUINAZOLINE COMPOUNDS AS PI3K INHIBITORS FOR THE TREATMENT OF CANCER INST MATERIA MEDICA CAMS (CN) 2025-07-30 EP disclosed
EP-4169918-B1 QUINAZOLINE DERIVATIVES AS INHIBITORS OF PI3K FOR THE TREATMENT OF CANCER INST MATERIA MEDICA CAMS (CN) 2025-07-30 EP disclosed
EP-3560921-B1 QUINAZOLINE COMPOUND, PREPARATION METHOD, APPLICATION AS PI3K INHIBITOR FOR THE TREATMENT OF CANCER, AND PHARMACEUTICAL COMPOSTION THEREOF INST MATERIA MEDICA CAMS (CN) 2024-08-14 EP disclosed
EP-4169917-A1 QUINAZOLINE COMPOUND AND PREPARATION METHOD, APPLICATION, AND PHARMACEUTICAL COMPOSTION THEREOF Institute of Materia Medica, Chinese Academy of Medical Sciences (CN) 2023-04-26 EP disclosed
EP-4169918-A1 QUINAZOLINE COMPOUND AND PREPARATION METHOD, APPLICATION, AND PHARMACEUTICAL COMPOSTION THEREOF Institute of Materia Medica, Chinese Academy of Medical Sciences (CN) 2023-04-26 EP disclosed
US-20230113478-A1 Quinazoline Compounds, Preparation Method, Use, and Pharmaceutical Composition Thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMYOF MEDICAL SCIENCES (CN) 2023-04-13 US disclosed
US-20230110550-A1 Quinazoline Compounds, Preparation Method, Use, and Pharmaceutical Composition Thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMYOF MEDICAL SCIENCES (CN) 2023-04-13 US disclosed
US-11534443-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2022-12-27 US disclosed
WO-2014022128-A1 PI3 KINASE MODULATORS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2014-02-06 WO disclosed
US-20140038991-A1 Protein Kinase Inhibitors ASTAR BIOTECH LLC (US) 2014-02-06 US disclosed
US-8637509-B2 Azaindazoles GLAXOSMITHKLINE LLC (US) 2014-01-28 US disclosed
WO-2013067302-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2013-05-10 WO disclosed
WO-2013039988-A1 AZAINDAZOLES GLAX0SMITHKLINE LLC (US) 2013-03-21 WO disclosed
US-20130059849-A1 AZAINDAZOLES GLAXOSMITHKLINE LLC 2013-03-07 US disclosed
WO-2012174312-A2 BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-12-20 WO disclosed
WO-2012037108-A1 AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed
WO-2012037108-A1 AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed
US-20100124550-A1 AMIDE INHIBITORS OF RENIN AUSPEX PHARMACEUTICALS, INC. (US) 2010-05-20 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 (8 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-20100124550-A1 AMIDE INHIBITORS OF RENIN REN, ACE, AGTR2 ALPL 937/4885PIK3CA 1232/4885MTOR 3521/4885
US-12508263-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof PIK3CA, PIK3R5, JAK1 ALPL 3258/4885PIK3CA 1/4885MTOR 15/4885
US-20230113478-A1 Quinazoline Compounds, Preparation Method, Use, and Pharmaceutical Composition Thereof PIK3CA, PIK3CD, PDPK1 ALPL 1635/4885PIK3CA 1/4885MTOR 27/4885
US-11534443-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof PIK3CA, PIK3CD, PDPK1 ALPL 1635/4885PIK3CA 1/4885MTOR 27/4885
US-12508264-B2 Quinazoline compounds, preparation method, use, and pharmaceutical composition thereof PIK3CA, PIK3C2A, PIK3R5 ALPL 2901/4885PIK3CA 1/4885MTOR 11/4885
US-20130059849-A1 AZAINDAZOLES AZI2, MKI67, DNMT1 ALPL 2734/4885PIK3CA 995/4885MTOR 1752/4885
US-20140038991-A1 Protein Kinase Inhibitors MAP3K1, MAP3K5, MAP3K7 ALPL 2923/4885PIK3CA 271/4885MTOR 131/4885
US-20230110550-A1 Quinazoline Compounds, Preparation Method, Use, and Pharmaceutical Composition Thereof PIK3CA, PIK3CD, PDPK1 ALPL 1635/4885PIK3CA 1/4885MTOR 27/4885

“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.