⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL7144997 | 0.84 | LMNA (0.67) | — | |
| Bicarbonate SCHEMBL4345305 | 0.83 | — | — | |
| Acetic Acid SCHEMBL6063417 | 0.78 | — | — | |
| Glycolic Acid SCHEMBL7716253 | 0.75 | TSHR (0.39) | — | |
| Sulfuric Acid SCHEMBL25293539 | 0.73 | CA5A (0.43) | — | |
| Urea SCHEMBL3385100 | 0.73 | — | — | |
| SCHEMBL8854658 | 0.73 | — | — | |
| SCHEMBL13493080 | 0.73 | — | — | |
| SCHEMBL5606321 | 0.73 | — | — | |
| SCHEMBL29277295 | 0.73 | — | — |
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 214 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117065081-A | Modified chitosan/Ag nanoparticle composite material and preparation method and application thereof | 武汉理工大学 | 2023-11-17 | — | — | CN | claimed |
| CN-115803319-A | Atropisomers of pyridazinone derivatives as herbicides | FMC公司 | 2023-03-14 | — | — | CN | claimed |
| EP-3522878-B1 | METHODS FOR INHIBITING CONVERSION OF CHOLINE TO TRIMETHYLAMINE (TMA) | PROCTER & GAMBLE (US) | 2021-03-31 | — | — | EP | claimed |
| CN-107275720-B | Aluminum-air battery electrolyte, aluminum-air battery and manufacturing method thereof | 深圳市航盛新材料技术有限公司 | 2021-01-15 | — | — | CN | claimed |
| US-10675256-B2 | Methods for inhibiting conversion of choline to trimethylamine (TMA) | THE PROCTER & GAMBLE COMPANY (US) | 2020-06-09 | — | — | US | claimed |
| EP-3522878-A1 | METHODS FOR INHIBITING CONVERSION OF CHOLINE TO TRIMETHYLAMINE (TMA) | The Procter and Gamble Company (US) | 2019-08-14 | — | — | EP | claimed |
| US-20190175743-A1 | OLIGOMER-BETA BLOCKER CONJUGATES | NEKTAR THERAPEUTICS | 2019-06-13 | — | — | US | claimed |
| WO-2019070677-A1 | METHODS FOR INHIBITING CONVERSION OF CHOLINE TO TRIMETHYLAMINE (TMA) | THE PROCTER & GAMBLE COMPANY (US) | 2019-04-11 | — | — | WO | claimed |
| US-20190099389-A1 | METHODS FOR INHIBITING CONVERSION OF CHOLINE TO TRIMETHYLAMINE (TMA) | THE CLEVELAND CLINIC FOUNDATION | 2019-04-04 | — | — | US | claimed |
| US-20170360948-A1 | OLIGOMER-BETA BLOCKER CONJUGATES | NEKTAR THERAPEUTICS | 2017-12-21 | — | — | US | claimed |
| US-4578403-A | Method for treating glaucoma by the topical administration of selectively metabolized beta-blocking agents | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1986-03-25 | — | — | US | claimed |
| WO-1985004580-A1 | PHARMACEUTICAL COMPOSITION AND METHOD FOR TREATMENT OR PROPHYLAXIS OF CARDIAC DISORDERS | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1985-10-24 | — | — | WO | claimed |
| EP-0131006-A4 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-06-06 | — | — | EP | claimed |
| US-4508725-A | BETA-ADRENERGIC BLOCKING AGENTS; GLAUCOMA TREATMENT | AMERICAN HOSPITAL SUPPLY CORPORATION (US) | 1985-04-02 | — | — | US | claimed |
| EP-0131006-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1985-01-16 | — | — | EP | claimed |
| WO-1984002525-A1 | ESTERS OF 3-(3-SUBSTITUTED-AMINO-2-HYDROXYPROPOXY)-4-SUBSTITUTED-1,2,5-THIADIAZOLE DERIVATIVES | AMERICAN HOSPITAL SUPPLY CORP (US) | 1984-07-05 | — | — | WO | claimed |
| EP-0093155-A4 | ESTERS OF ARYLOXYPROPANOLAMINE DERIVATIVES AND USE AS BETA-ADRENERGIC BLOCKING AGENTS. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1984-04-24 | — | — | EP | claimed |
| EP-0093155-A1 | ESTERS OF ARYLOXYPROPANOLAMINE DERIVATIVES AND USE AS BETA-ADRENERGIC BLOCKING AGENTS. | AMERICAN HOSPITAL SUPPLY CORP (US) | 1983-11-09 | — | — | EP | claimed |
| WO-1983001772-A1 | ESTERS OF ARYLOXYPROPANOLAMINE DERIVATIVES AND USE AS 'beta'-ADRENERGIC BLOCKING AGENTS | AMERICAN HOSPITAL SUPPLY CORP (US) | 1983-05-26 | — | — | WO | claimed |
| US-4244731-A | APPLYING A CARBOXY DERIVATIVE OF A 2,6-DIMETHYLPHENOXY COMPOUND | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1981-01-13 | — | — | US | claimed |