⚠ 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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL28210795 | 0.86 | LMNA (0.32) | — | |
| SCHEMBL9743284 | 0.80 | TYMP (0.31) | — | |
| SCHEMBL9052845 | 0.75 | POLB (0.35) | — | |
| SCHEMBL11101193 | 0.74 | TSHR (0.33) | — | |
| SCHEMBL11757540 | 0.74 | LMNA (0.30) | — | |
| SCHEMBL27800402 | 0.71 | GRIN1 (0.41) | — | |
| SCHEMBL4877997 | 0.70 | — | — | |
| SCHEMBL29172397 | 0.70 | — | — | |
| SCHEMBL11690765 | 0.69 | POLB (0.33) | — | |
| SCHEMBL1833932 | 0.69 | POLB (0.47) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109880062-A | A kind of cross-linkable solidifying material and its continuous production method | 广东博兴新材料科技有限公司 | 2019-06-14 | — | — | CN | claimed |
| CN-109876858-A | One kind preparation method of (methyl) acrylate substance and the application of 2- acrylamide-2-methyl propane sulfonic | 广东博兴新材料科技有限公司 | 2019-06-14 | — | — | CN | claimed |
| CN-109776312-A | A kind of preparation method of acryloxy propionic ester type compound | 衡阳师范学院 | 2019-05-21 | — | — | CN | claimed |
| CN-109734586-A | Treatment method for recycling (methyl) acrylic acid in esterification reaction system | 广东博兴新材料科技有限公司 | 2019-05-10 | — | — | CN | claimed |
| CN-109876858-A | One kind preparation method of (methyl) acrylate substance and the application of 2- acrylamide-2-methyl propane sulfonic | 广东博兴新材料科技有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-109776312-A | A kind of preparation method of acryloxy propionic ester type compound | 衡阳师范学院 | 2019-05-21 | — | — | CN | disclosed |