Atovaquone

Atovaquone

SCHEMBL9975142

O=C1C(O)=C(C2CCC(c3ccc(Cl)cc3)CC2)C(=O)c2ccccc21

nearest known ligand 0.82

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 4/20 0.82
KMT2A Q03164 4/20 0.82
MEN1 O00255 3/20 0.82
LMNA P02545 2/20 0.82
USP2 O75604 1/20 0.82
TP53 P04637 1/20 0.82
CYP1A2 P05177 1/20 0.82
CYP2C9 P11712 1/20 0.82
HPGD P15428 1/20 0.82
TSHR P16473 1/20 0.82
HIF1A Q16665 1/20 0.82
APAF1 O14727 1/20 0.43
TDP2 O95551 1/20 0.43
RAB9A P51151 1/20 0.42
DHODH Q02127 2/20 0.42
ALDH1A1 P00352 4/20 0.41
HTT P42858 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
ALOX12 P18054 2/20 0.41
POLB P06746 1/20 0.41

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 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL20769805 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL637069 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL1542719 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL29559044 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL8848607 1.00 MAPT (0.82) MAPTKMT2AMEN1LMNAUSP2
Atovaquone SCHEMBL8851283 0.90 MAPT (0.67) MAPTKMT2AMEN1LMNAUSP2
SCHEMBL21695 0.90 MAPT (1.00) MAPTKMT2AMEN1LMNAUSP2
SCHEMBL1649508 0.90 MAPT (1.00) MAPTKMT2AMEN1LMNAUSP2
SCHEMBL28082527 0.89 MAPT (0.73) MAPTKMT2AMEN1LMNAUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20230218547-A1 CHEMICAL COMPOSITION THE JOHN HOPKINS UNIVERSITY 2023-07-13 US disclosed
US-20230201135-A1 USE OF ATOVAQUONE AND PROGUANIL FOR TREATMENT OF GASTROINTESTINAL DISEASES AND INFLAMMATION ELEVAID THERAPEUTICS, INC. (US) 2023-06-29 US disclosed
US-20230201135-A1 USE OF ATOVAQUONE AND PROGUANIL FOR TREATMENT OF GASTROINTESTINAL DISEASES AND INFLAMMATION ELEVAID THERAPEUTICS, INC. (US) 2023-06-29 US disclosed
US-20230111793-A1 ANTIMALARIAL COMPOSITIONS AND USES THEREOF SCRIPPS RESEARCH INST (US) 2023-04-13 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
US-20220265566-A1 ATOVAQUONE NANOPARTICULATE COMPOSITIONS TULEX PHARMACEUTICALS INC (US) 2022-08-25 US disclosed
WO-2022144920-A1 ATOVAQUONE PRODRUGS IPCA LABORATORIES LIMITED (IN) 2022-07-07 WO disclosed
EP-3345594-B1 SOLUBILIZED FLAVONOID COMPOSITION TECH INVESTMENTS LC (US) 2021-11-17 EP disclosed
US-20210179524-A1 ANTIMALARIAL COMPOSITIONS AND USES THEREOF SCRIPPS RESEARCH INST (US) 2021-06-17 US disclosed
US-20100069428-A1 ACRIDONE COMPOUNDS THE GOVERNMENT OF THE UNITED STATES, AS REPRESENTED BY THE SECRETARY OF THE ARMY 2010-03-18 US disclosed
WO-2010023686-A2 CRYSTALLINE FORM OF 2-CHLORO-3-[4-(4-CHLOROPHENYL) CYCLOHEXYL] [1,4]NAPHTHOQUINONE, PROCESS FOR THE SAME AND USE FOR PRODUCING 2-[4-(4-CHLOROPHENYL)CYCLOHEXYL]-3- HYDROXY- 1,4- NAPHTHOQUINONE MATRIX LABORATORIES LIMITED (IN) 2010-03-04 WO disclosed
US-20100028425-A1 PHARMACEUTICAL COMPOSITION OF ATOVAQUONE GLENMARK GENERICS LTD. (IN) 2010-02-04 US disclosed
US-20100028425-A1 PHARMACEUTICAL COMPOSITION OF ATOVAQUONE GLENMARK GENERICS LTD. (IN) 2010-02-04 US disclosed
WO-2010001379-A1 A PROCESS FOR PREPARING ATOVAQUONE AND ASSOCIATE INTERMEDIATES CHEMAGIS LTD. (IL) 2010-01-07 WO disclosed
US-20090105350-A1 Process for the preparation of atovaquone GLENMARK PHARMACEUTICALS LIMITED (IN) 2009-04-23 US disclosed
US-20090105350-A1 Process for the preparation of atovaquone GLENMARK PHARMACEUTICALS LIMITED (IN) 2009-04-23 US disclosed
WO-2009007996-A2 CYCLODEXTRIN COMPLEXES OF ATOVAQUONE SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2009-01-15 WO disclosed
WO-2009007991-A2 A NEW PROCESS FOR PREPARATION OF ATOVAQUONE AND NOVEL INTERMEDIATES THEREOF IPCA LABORATORIES LIMITED (IN) 2009-01-15 WO disclosed
WO-2008122988-A1 PROCESS FOR PREPARATION OF ATOVAQUONE AND THE CONVERSION OF CIS-ISOMER TO TRANS- ISOMER CADILA HEALTHCARE LIMITED (IN) 2008-10-16 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 (9 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-20220265566-A1 ATOVAQUONE NANOPARTICULATE COMPOSITIONS RECQL, ATIC, POLQ MAPT 1168/4885KMT2A 1080/4885MEN1 1959/4885
US-20230218547-A1 CHEMICAL COMPOSITION NDUFA10, NDUFA3, NDUFB10 MAPT 897/4885KMT2A 1883/4885MEN1 1962/4885
US-20210179524-A1 ANTIMALARIAL COMPOSITIONS AND USES THEREOF GPX4, MPO, G6PD MAPT 1240/4885KMT2A 2654/4885MEN1 1766/4885
US-20100028425-A1 PHARMACEUTICAL COMPOSITION OF ATOVAQUONE CYP2C19, NDUFA10, ATP6V1H MAPT 1090/4885KMT2A 3310/4885MEN1 1939/4885
US-20230017373-A1 Mitochondria-Targeted Atovaqone: A More Potent and More Effective Antitumor, Antimicrobial, and Antimalarial Drug MAVS, MT-ATP6, MT-ND2 MAPT 2733/4885KMT2A 1927/4885MEN1 1436/4885
US-20090105350-A1 Process for the preparation of atovaquone POLQ, ATIC, CYP2S1 MAPT 2334/4885KMT2A 1620/4885MEN1 3858/4885
US-20230111793-A1 ANTIMALARIAL COMPOSITIONS AND USES THEREOF GPX4, MPO, G6PD MAPT 1240/4885KMT2A 2654/4885MEN1 1766/4885
US-20100069428-A1 ACRIDONE COMPOUNDS ACR, ABCC1, SLC11A2 MAPT 294/4885KMT2A 3587/4885MEN1 3731/4885
US-20230201135-A1 USE OF ATOVAQUONE AND PROGUANIL FOR TREATMENT OF GASTROINTESTINAL DISEASES AND INFLAMMATION IL4I1, MPO, TPMT MAPT 2698/4885KMT2A 2285/4885MEN1 3469/4885

“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.