⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL272583 | 0.78 | — | — | |
| Lactic Acid SCHEMBL26674102 | 0.72 | TP53 (0.85) | — | |
| SCHEMBL2337322 | 0.72 | — | — | |
| Lactic Acid SCHEMBL27901579 | 0.72 | — | — | |
| Lactic Acid SCHEMBL671361 | 0.72 | — | — | |
| Lactic Acid SCHEMBL1517852 | 0.72 | TP53 (0.85) | — | |
| L-Lactic Acid SCHEMBL28491937 | 0.72 | TP53 (0.50) | — | |
| SCHEMBL6827448 | 0.72 | — | — | |
| SCHEMBL4598639 | 0.72 | — | — | |
| L-Lactic Acid SCHEMBL13165963 | 0.70 | — | — |
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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | claimed |
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | disclosed |
| CN-105308162-B | Compounds for the controlled release of active molecules | 弗门尼舍有限公司 | 2022-10-11 | — | — | CN | disclosed |
| CN-111521708-B | Specific molecular marker for aspergillus flavus infection mildew of corn, peanut and walnut and method for detecting early mildew by using specific molecular marker | 陕西科技大学 | 2022-08-16 | — | — | CN | disclosed |
| CN-114727924-A | Pro-fragrance compositions | 弗门尼舍有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-111521708-A | Specific molecular marker for aspergillus flavus infection mildew of corn, peanut and walnut and method for detecting early mildew by using specific molecular marker | 陕西科技大学 | 2020-08-11 | — | — | CN | disclosed |
| CN-1261404-C | Process for preparing beta-ketoenol esters | BASF AG (DE) | 2006-06-28 | — | — | CN | disclosed |
| US-6903221-B2 | Method for producing β-ketoenol esters | BASF AKTIENGESELLSCHAFT (DE) | 2005-06-07 | — | — | US | disclosed |
| CN-1461294-A | Process for preparing beta-ketoenol esters | BASF AG (DE) | 2003-12-10 | — | — | CN | disclosed |
| US-20030191318-A1 | Method for producing beta ketoenol esters | BASF AKTIENGESELLSCHAFT (DE) | 2003-10-09 | — | — | US | disclosed |
| US-6589915-B1 | The invention relates to cyclohexenone derivatives of benzo-condensed, unsaturated 5-ring nitrogen heterocycles of general formula (I) wherein X represents N or a group C-R3, Y represents O, S, SO, SO2 or NR4 or X-Y represent S | BASF AKTIENGESELLSCHAFT (DE) | 2003-07-08 | — | — | US | disclosed |
| EP-1311469-A1 | METHOD FOR PRODUCING BETA- KETOENOL ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2003-05-21 | — | — | EP | disclosed |
| US-6541423-B1 | Controlling vegatation | BASF AKTIENGESELLSCHAFT (DE) | 2003-04-01 | — | — | US | disclosed |
| WO-2002016305-A1 | METHOD FOR PRODUCING β KETOENOL ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-28 | — | — | WO | disclosed |
| EP-1177179-A1 | BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-06 | — | — | EP | disclosed |
| EP-1177194-A1 | 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 2002-02-06 | — | — | EP | disclosed |
| WO-2001000584-A2 | PYRAZOLYL DERIVATIVES OF BICYCLIC BENZOIC ACIDS FOR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-04 | — | — | WO | disclosed |
| WO-2001000607-A1 | CYCLOHEXENONE DERIVATIVES OF BICYCLIC BENZOIC ACIDS AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-04 | — | — | WO | disclosed |
| WO-2000068228-A1 | 4-(3',4'-HETEROCYCLYL BENZOYL) PYRAZOLES AS HERBICIDAL AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-16 | — | — | WO | disclosed |
| WO-2000068210-A1 | BENZOHETERO CYCLYLCYCLO HEXENONES AND THEIR USE AS HERBICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-16 | — | — | WO | disclosed |