⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15699742 | 1.00 | — | — | |
| SCHEMBL19668472 | 0.83 | ALDH1A1 (0.50) | — | |
| SCHEMBL3912069 | 0.82 | — | — | |
| SCHEMBL6443759 | 0.82 | — | — | |
| SCHEMBL28107178 | 0.81 | CYP2C19 (0.42) | — | |
| SCHEMBL26606264 | 0.77 | ALDH1A1 (0.48) | — | |
| SCHEMBL1079959 | 0.77 | — | — | |
| SCHEMBL9776930 | 0.77 | — | — | |
| SCHEMBL17291878 | 0.76 | ALDH1A1 (0.48) | — | |
| SCHEMBL3364238 | 0.75 | — | — |
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-104906212-B | Raisin tree seed extract and its extraction separation method with hepatoprotective effect and purposes | 暨南大学 | 2018-07-13 | — | — | CN | disclosed |
| US-9523105-B2 | Fermentation route for the production of levulinic acid, levulinate esters and valerolactone and derivatives thereof | ARZEDA CORPORATION (US) | 2016-12-20 | — | — | US | disclosed |
| CN-104906212-A | Semen hoveniae extracts with liver protection function and extraction and separation method and application thereof | UNIV JINAN | 2015-09-16 | — | — | CN | disclosed |
| CN-101250207-B | Canton love-pea vine total flavone c-glycosides effective part, preparation method and use thereof | UNIV CHINA PHARMA | 2011-01-12 | — | — | CN | disclosed |
| US-7540184-B2 | Analyzing method for coloring material composition | SEIKO EPSON CORPORATION (JP) | 2009-06-02 | — | — | US | disclosed |
| CN-101250207-A | Canton love-pea vine total flavone c-glycosides effective part, preparation method and use thereof | UNIV CHINA PHARMA (CN) | 2008-08-27 | — | — | CN | disclosed |
| US-20060150716-A1 | Analyzing method for coloring material composition | SEIKO EPSON CORPORATION | 2006-07-13 | — | — | US | disclosed |
| EP-0435843-B1 | Substituted pyridine compounds | MONSANTO CO (US) | 1994-06-15 | — | — | EP | disclosed |
| US-5129943-A | Herbicides | MONSANTO COMPANY (US) | 1992-07-14 | — | — | US | disclosed |
| US-5114465-A | Substituted pyridine compounds and herbicidal compositions and methods | MONSANTO COMPANY (US) | 1992-05-19 | — | — | US | disclosed |
| US-5112980-A | Intermediates for herbicides | MONSANTO COMPANY (US) | 1992-05-12 | — | — | US | disclosed |
| EP-0435844-A1 | Substituted pyridine compounds | MONSANTO COMPANY (US) | 1991-07-03 | — | — | EP | disclosed |
| US-4310536-A | Rodenticidal compositions | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1982-01-12 | — | — | US | disclosed |