⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21049748 | 0.84 | THRB (0.35) | — | |
| Tetrahydrofuran SCHEMBL21049750 | 0.78 | ALDH1A1 (0.31) | — | |
| Tetrahydrofuran SCHEMBL21049753 | 0.78 | ALDH1A1 (0.31) | — | |
| Tetrahydrofuran SCHEMBL28447289 | 0.75 | — | — | |
| Tetrahydrofuran SCHEMBL28267891 | 0.74 | ALDH1A1 (0.31) | — | |
| Tetrahydrofuran SCHEMBL21049751 | 0.74 | ALDH1A1 (0.31) | — | |
| Tetrahydrofuran SCHEMBL2202326 | 0.72 | ALDH1A1 (0.40) | — | |
| Monochloroacetal SCHEMBL9751725 | 0.69 | ALDH1A1 (0.33) | — | |
| Tetrahydrofuran SCHEMBL10505828 | 0.69 | THRB (0.58) | — | |
| Tetrahydrofuran SCHEMBL20695763 | 0.69 | LMNA (0.37) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3495374-B1 | SIMPLE PREPARATION METHOD FOR DIALKOXYPROPYL METHYLPHOSPHONATE | JIANGSU GOOD HARVEST WEIEN AGROCHEMICAL CO LTD (CN) | 2020-10-28 | — | — | EP | disclosed |
| CN-109134534-B | Simple preparation method of 3, 3-dialkoxy propyl methylphosphonate | 江苏好收成韦恩农化股份有限公司 | 2020-09-08 | — | — | CN | disclosed |
| US-10759818-B2 | Simple preparation method for dialkoxypropyl methylphosphonate | JIANGSU GOOD HARVEST-WEIEN AGROCHEMICAL CO., LTD (CN) | 2020-09-01 | — | — | US | disclosed |
| US-20190284215-A1 | SIMPLE PREPARATION METHOD FOR DIALKOXYPROPYL METHYLPHOSPHONATE | JIANGSU GOOD HARVEST-WEIEN AGROCHEMICAL CO., LTD (CN) | 2019-09-19 | — | — | US | disclosed |
| EP-3495374-A1 | SIMPLE PREPARATION METHOD FOR DIALKOXYPROPYL METHYLPHOSPHONATE | Jiangsu Good Harvest-Weien Agrochemical Co., Ltd (CN) | 2019-06-12 | — | — | EP | disclosed |