Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL11263634 | 0.84 | LDHA (0.53) | — | |
| SCHEMBL326094 | 0.80 | — | — | |
| SCHEMBL11183647 | 0.78 | SUCNR1 (0.60) | — | |
| Benzene SCHEMBL17493144 | 0.77 | TSHR (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL754852 | 0.76 | — | — | |
| Water SCHEMBL5382704 | 0.76 | — | — | |
| SCHEMBL9312342 | 0.76 | — | — | |
| Fluoride SCHEMBL7573266 | 0.76 | — | — | |
| Sulfuric Acid SCHEMBL11597740 | 0.76 | — | — | |
| Benzene SCHEMBL9502655 | 0.76 | CA5A (0.33) | — |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107746371-A | A kind of Megastigmatrienone synthesis technique | 云南省玉溪市云溪香精香料有限责任公司 | 2018-03-02 | — | — | CN | claimed |
| CN-110191890-B | Chemical substances for coating nanostructures | 斯帕果纳米医学有限公司 | 2022-11-15 | — | — | CN | disclosed |
| US-11401376-B2 | Chemical compounds for coating of nanostructures | SPAGO NANOMEDICAL AB (SE) | 2022-08-02 | — | — | US | disclosed |
| EP-3568403-B1 | CHEMICAL COMPOUNDS FOR COATING OF NANOSTRUCTURES | SPAGO NANOMEDICAL AB (SE) | 2021-04-21 | — | — | EP | disclosed |
| US-20190352459-A1 | Chemical Compounds For Coating Of Nanostructures | SPAGO NANOMEDICAL AB (SE) | 2019-11-21 | — | — | US | disclosed |
| EP-3568403-A1 | CHEMICAL COMPOUNDS FOR COATING OF NANOSTRUCTURES | Spago Nanomedical AB (SE) | 2019-11-20 | — | — | EP | disclosed |
| WO-2018130713-A1 | CHEMICAL COMPOUNDS FOR COATING OF NANOSTRUCTURES | SPAGO NANOMEDICAL AB (SE) | 2018-07-19 | — | — | WO | disclosed |
| EP-3348560-A1 | CHEMICAL COMPOUNDS FOR COATING OF NANOSTRUCTURES | Spago Nanomedical AB (SE) | 2018-07-18 | — | — | EP | disclosed |
| US-20050044778-A1 | Fuel compositions employing catalyst combustion structure | OCTANE INTERNATIONAL, LTD. | 2005-03-03 | — | — | US | disclosed |
| EP-1051461-A2 | FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE | ORR, William C. (US) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999066009-A2 | FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE | ORR WILLIAM C (US) | 1999-12-23 | — | — | WO | disclosed |
| EP-0254596-B1 | MANUFACTURING METHOD FOR 2-HYDROXYNAPHTALENE-6-CARBOXYLIC ACID | Kabushiki Kaisha Ueno Seiyaku Oyo Kenkyujo (JP) | 1993-02-10 | — | — | EP | disclosed |
| US-5011984-A | Reacting potassium 2-hydroxynaphthalene-6-carboxylic acid with carbon dioxide; removal of beta-naphthol and water in vapor phase | KABUSHIKI KAISHA UENO SEIYAKU OYO KENKYUJO (JP) | 1991-04-30 | — | — | US | disclosed |