SCHEMBL10225658

SCHEMBL10225658

CNC(=O)c1cccc(-c2ccc3c(N4CCOC[C@@H]4C)nc(N4CCCC[C@@H]4C)nc3n2)c1

nearest known ligand 0.89

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTOR P42345 20/20 0.89
PIK3CA P42336 2/20 0.89
PIK3CD O00329 1/20 0.89
PIK3R1 P27986 1/20 0.89
PIK3CB P42338 1/20 0.89
PIK3CG P48736 1/20 0.89
PFKP Q01813 1/20 0.89
KCNH2 Q12809 1/20 0.89
RPTOR Q8N122 1/20 0.89
PIK3C3 Q8NEB9 1/20 0.89
MLST8 Q9BVC4 1/20 0.89

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
Vistusertib SCHEMBL22449928 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL1214881 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL29397309 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL29353400 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL20734874 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL290672 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
Vistusertib SCHEMBL29350053 0.94 MTOR (1.00) MTORPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL23604916 0.90 MTOR (0.82) MTORPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL23604917 0.90 MTOR (0.82) MTORPIK3CAPIK3CDPIK3R1PIK3CB
SCHEMBL22449835 0.90 MTOR (0.90) MTORPIK3CAPIK3CDPIK3R1PIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066035-A1 Methods for Enhancing Cytotoxic Cancer Therapy Through Inhibition of ATG4B NORTHWESTERN UNIVERSITY 2024-02-29 US disclosed
US-11793816-B2 Methods for enhancing cytotoxic cancer therapy through inhibition of ATG4B NORTHWESTERN UNIVERSITY (US) 2023-10-24 US disclosed
US-10034884-B2 Pyrido-, pyrazo- and pyrimido-pyrimidine derivatives as mTOR inhibitors KUDOS PHARMACEUTICALS LIMITED (GB) 2018-07-31 US disclosed
US-9717736-B2 Pyrido-, pyrazo- and pyrimido-pyrimidine derivatives as mTOR inhibitors KUDOS PHARMACEUTICALS LIMITED (GB) 2017-08-01 US disclosed
US-9657008-B2 Chemical compounds ASTRAZENECA AB (SE) 2017-05-23 US disclosed
US-20160137634-A1 Chemical Compounds ASTRAZENECA AB (SE) 2016-05-19 US disclosed
US-20160067258-A1 Pyrido-, Pyrazo- and Pyrimido-Pyrimidine Derivatives as mTOR Inhibitors KUDOS PHARM LTD (GB) 2016-03-10 US disclosed
US-20160009785-A1 NOVEL FUSION MOLECULES AND USES THEREOF FOUNDATION MEDICINE, INC. 2016-01-14 US disclosed
US-9156831-B2 Chemical compounds ASTRAZENECA AB (SE) 2015-10-13 US disclosed
US-9102670-B2 Pyrido-, pyrazo- and pyrimido-pyrimidine derivatives as mTOR inhibitors KUDOS PHARMACEUTICALS LIMITED (GB) 2015-08-11 US disclosed
US-20140206700-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2014-07-24 US disclosed
US-8101602-B2 Pyrido-, pyrazo- and pyrimido-pyrimidine derivatives as mTOR inhibitors Kudos Pharmaceuticals, Ltd. (GB) 2012-01-24 US disclosed
US-20110124638-A1 Pyrido-, Pyrazo- and Pyrimido-Pyrimidine Derivatives as mTOR Inhibitors KUDOS PHARMACEUTICALS LIMITED (GB) 2011-05-26 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-20140206700-A1 CHEMICAL COMPOUNDS MKI67, CCNI, TP53 MTOR 461/4885PIK3CA 1124/4885PIK3CD 2304/4885
US-20240066035-A1 Methods for Enhancing Cytotoxic Cancer Therapy Through Inhibition of ATG4B ATG4B, ATG4A, ATG7 MTOR 219/4885PIK3CA 883/4885PIK3CD 408/4885
US-20160137634-A1 Chemical Compounds MKI67, CCNI, TP53 MTOR 461/4885PIK3CA 1124/4885PIK3CD 2304/4885
US-11793816-B2 Methods for enhancing cytotoxic cancer therapy through inhibition of ATG4B ATG4B, ATG4A, ATG7 MTOR 219/4885PIK3CA 883/4885PIK3CD 408/4885
US-10034884-B2 Pyrido-, pyrazo- and pyrimido-pyrimidine derivatives as mTOR inhibitors MTOR, RICTOR, RPTOR MTOR 1/4885PIK3CA 11/4885PIK3CD 40/4885
US-20160067258-A1 Pyrido-, Pyrazo- and Pyrimido-Pyrimidine Derivatives as mTOR Inhibitors MTOR, RICTOR, RPTOR MTOR 1/4885PIK3CA 11/4885PIK3CD 40/4885
US-20110124638-A1 Pyrido-, Pyrazo- and Pyrimido-Pyrimidine Derivatives as mTOR Inhibitors MTOR, RICTOR, RPTOR MTOR 1/4885PIK3CA 9/4885PIK3CD 38/4885
US-20160009785-A1 NOVEL FUSION MOLECULES AND USES THEREOF RPS27A, CD2BP2, FGB MTOR 4823/4885PIK3CA 2528/4885PIK3CD 2475/4885

“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.