Atovaquone

Atovaquone

SCHEMBL8851283

O=C1C(O)=C([C@H]2CC[C@H](c3ccc(Cl)cc3)CC2)C(=O)c2ccccc21.O=C1C=C(O)C(=O)c2ccccc21

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MT-CYB

The experimentally established mechanism targets of Atovaquone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.67
HPGD P15428 2/20 0.67
MEN1 O00255 2/20 0.67
KMT2A Q03164 2/20 0.67
TP53 P04637 2/20 0.67
USP2 O75604 1/20 0.67
LMNA P02545 1/20 0.67
CYP1A2 P05177 1/20 0.67
CYP2C9 P11712 1/20 0.67
TSHR P16473 1/20 0.67
HIF1A Q16665 1/20 0.67
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
POLB P06746 1/20 0.37
ALOX12 P18054 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPK1 P28482 2/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
Atovaquone SCHEMBL21694 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL20769805 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL29559044 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL9975142 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL637069 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL8848607 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Atovaquone SCHEMBL1542719 0.90 MAPT (0.82) MAPTHPGDMEN1KMT2ATP53
Lawsone SCHEMBL8445723 0.85 MAPT (0.55) MAPTHPGDMEN1KMT2ATP53
SCHEMBL21695 0.81 MAPT (1.00) MAPTHPGDMEN1KMT2ATP53
SCHEMBL1649508 0.81 MAPT (1.00) MAPTHPGDMEN1KMT2ATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12594283-B2 Mitochondria-targeted atovagone: a more potent and more effective antitumor, antimicrobial, and antimalarial drug THE MEDICAL COLLEGE OF WISCONSIN, INC. (US) 2026-04-07 US disclosed
EP-4048246-B1 MITOCHONDRIA-TARGETED ATOVAQUONE: A MORE POTENT AND MORE EFFECTIVE ANTITUMOR, ANTIMICROBIAL, AND ANTIMALARIAL DRUG MEDICAL COLLEGE WISCONSIN INC (US) 2024-07-10 EP disclosed
US-11964944-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases THE UNIVERSITY OF CHICAGO (US) 2024-04-23 US disclosed
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2023-05-04 US disclosed
US-20230017373-A1 Mitochondria-Targeted Atovaqone: A More Potent and More Effective Antitumor, Antimicrobial, and Antimalarial Drug THE MEDICAL COLLEGE OF WISCONSIN, INC. 2023-01-19 US disclosed
EP-4048246-A1 MITOCHONDRIA-TARGETED ATOVAQUONE: A MORE POTENT AND MORE EFFECTIVE ANTITUMOR, ANTIMICROBIAL, AND ANTIMALARIAL DRUG The Medical College of Wisconsin, Inc. (US) 2022-08-31 EP disclosed
US-11414385-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases THE UNIVERSITY OF CHICAGO 2022-08-16 US disclosed
WO-2021081500-A1 MITOCHONDRIA-TARGETED ATOVAQUONE: A MORE POTENT AND MORE EFFECTIVE ANTITUMOR, ANTIMICROBIAL, AND ANTIMALARIAL DRUG THE MEDICAL COLLEGE OF WISCONSIN, INC. (US) 2021-04-29 WO disclosed
US-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases THE UNIVERSITY OF CHICAGO 2020-09-10 US disclosed
EP-3394032-A1 COMPOUNDS AND METHODS FOR TREATING, DETECTING, AND IDENTIFYING COMPOUNDS TO TREAT APICOMPLEXAN PARASITIC DISEASES The University of Chicago (US) 2018-10-31 EP disclosed
WO-2017112678-A1 COMPOUNDS AND METHODS FOR TREATING, DETECTING, AND IDENTIFYING COMPOUNDS TO TREAT APICOMPLEXAN PARASITIC DISEASES MCLEOD RIMA (US) 2017-06-29 WO disclosed
US-5670496-A Treatment for toxoplasmosis with a composition comprising a folate antagonist and a spiropiperidyl derivative of rifamycin S PALO ALTO MEDICAL FOUNDATION (US) 1997-09-23 US disclosed
US-5665707-A Treatment for toxoplasmosis with a composition comprising a lincosamide and a spiropiperidyl derivative of rifamycik S PALO ALTO MEDICAL FOUNDATION (US) 1997-09-09 US disclosed
US-5650405-A Treatment for toxoplasmosis with a composition comprising a sulfonamide and a spiropiperidyl derivative of rifamycin S. PALO ALTO MEDICAL FOUNDATION (US) 1997-07-22 US disclosed
US-5648345-A Treatment for toxoplasmosis with a composition comprising a macrolide antibiotic and a spiropiperidyl derivative of rifamycin S PALO ALTO MEDICAL FOUNDATION (US) 1997-07-15 US disclosed
US-5641769-A treatment for toxoplasmoisis with a composition containing a hydroxynaphthoquinone and a spiropiperidyl derivative of rifamycin S. PALO ALTO MEDICAL FOUNDATION (US) 1997-06-24 US disclosed
EP-0648121-B1 USE OF RIFAMYCIN DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TOXOPLASMOSIS PALO ALTO MEDICAL FOUND (US) 1996-10-02 EP disclosed
US-5529994-A Treatment for toxoplasmosis PALO ALTO MEDICAL FOUNDATION (US) 1996-06-25 US disclosed
EP-0648121-A1 USE OF RIFAMYCIN DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TOXOPLASMOSIS. PALO ALTO MEDICAL FOUND (US) 1995-04-19 EP disclosed
WO-1994025038-A1 USE OF RIFAMYCIN DERIVATIVES FOR THE MANUFACTURE OF A MEDICAMENT FOR THE TREATMENT OF TOXOPLASMOSIS PALO ALTO MEDICAL FOUNDATION (US) 1994-11-10 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 (6 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-20200283391-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases TUBB1, MYADM, TUBB MAPT 2969/4885HPGD 433/4885MEN1 4473/4885
US-11964944-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases TUBB1, MYADM, TUBB MAPT 2933/4885HPGD 354/4885MEN1 4456/4885
US-20230140413-A1 Compounds and Methods for Treating, Detecting, and Identifying Compounds to Treat Apicomplexan Parasitic Diseases TUBB1, MYADM, TUBB MAPT 2933/4885HPGD 354/4885MEN1 4456/4885
US-11414385-B2 Compounds and methods for treating, detecting, and identifying compounds to treat apicomplexan parasitic diseases TUBB1, MYADM, TUBB MAPT 2969/4885HPGD 433/4885MEN1 4473/4885
US-20230017373-A1 Mitochondria-Targeted Atovaqone: A More Potent and More Effective Antitumor, Antimicrobial, and Antimalarial Drug MAVS, MT-ATP6, MT-ND2 MAPT 2733/4885HPGD 718/4885MEN1 1436/4885
US-12594283-B2 Mitochondria-targeted atovagone: a more potent and more effective antitumor, antimicrobial, and antimalarial drug TFAM, MT-CO2, HADHA MAPT 3721/4885HPGD 1000/4885MEN1 3740/4885

“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.