⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL619208 | 1.00 | — | — | |
| SCHEMBL13518411 | 1.00 | — | — | |
| SCHEMBL30854321 | 1.00 | — | — | |
| SCHEMBL9275294 | 1.00 | — | — | |
| SCHEMBL268213 | 1.00 | — | — | |
| SCHEMBL17590201 | 1.00 | — | — | |
| SCHEMBL14387629 | 1.00 | — | — | |
| Bicarbonate SCHEMBL3708811 | 0.95 | PDE4A (0.46) | — | |
| Phosphoric Acid SCHEMBL30182555 | 0.90 | PDE4A (0.38) | — | |
| Phosphoric Acid SCHEMBL29852280 | 0.90 | PDE4A (0.38) | — |
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-117903386-A | Method for realizing liquid phase polymerization of high-concentration polyhydroxy aldehyde or (and) polyhydroxy ketone through liquid thereof under high-temperature condition | 厦门碳控科技投资有限公司 | 2024-04-19 | — | — | CN | claimed |
| US-20240207209-A1 | Threonate Compounds and Methods of Use Thereof | NEUROCENTRIA, INC. | 2024-06-27 | — | — | US | disclosed |
| CN-117903386-A | Method for realizing liquid phase polymerization of high-concentration polyhydroxy aldehyde or (and) polyhydroxy ketone through liquid thereof under high-temperature condition | 厦门碳控科技投资有限公司 | 2024-04-19 | — | — | CN | disclosed |
| US-20230355556-A1 | Threonate Compounds and Methods of Use Thereof | NEUROCENTRIA, INC. | 2023-11-09 | — | — | US | disclosed |
| US-20170128397-A1 | THREONATE COMPOUNDS AND METHODS OF USE THEREOF | NEUROCENTRIA, INC. | 2017-05-11 | — | — | US | disclosed |
| WO-2012072630-A1 | PROCESS FOR PRODUCING FLAVOURS | GIVAUDAN SA (CH) | 2012-06-07 | — | — | WO | disclosed |
| WO-2012072631-A1 | PROCESS FOR PRODUCING FLAVOURS | GIVAUDAN SA (CH) | 2012-06-07 | — | — | WO | disclosed |
| EP-1038018-A4 | ALDOL CONDENSATIONS BY CATALYTIC ANTIBODIES | SCRIPPS RESEARCH INST (US) | 2004-10-13 | — | — | EP | disclosed |
| US-6589766-B1 | Use to catalyze ketone-ketone, ketone-aldehyde, aldehyde-ketone, and aldehyde-aldehyde intermolecular aldol reactions, and in some cases to catalyze their subsequent dehydration to yield aldol condensation products | THE SCRIPPS RESEARCH INSTITUTE | 2003-07-08 | — | — | US | disclosed |
| US-20020142422-A1 | Moss genes from physcomitrella patens encoding proteins involved in the synthesis of amino acids, vitamins, cofactors, nucleotides and nucleosides | BASF PLANT SCIENCE GMBH (DE) | 2002-10-03 | — | — | US | disclosed |
| US-6326176-B1 | ALDOL CONDENSATIONS AND CATALYTIC ANTIBODIES | THE SCRIPPS RESEARCH INSTITUTE | 2001-12-04 | — | — | US | disclosed |
| EP-1038018-A1 | ALDOL CONDENSATIONS BY CATALYTIC ANTIBODIES | The Scripps Research Institute (US) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999031263-A1 | ALDOL CONDENSATIONS BY CATALYTIC ANTIBODIES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1999-06-24 | — | — | WO | disclosed |