⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7455804 | 0.81 | TDP1 (0.31) | — | |
| SCHEMBL27642836 | 0.76 | — | — | |
| SCHEMBL138960 | 0.75 | — | — | |
| SCHEMBL3390384 | 0.75 | — | — | |
| SCHEMBL22654555 | 0.75 | — | — | |
| SCHEMBL20291479 | 0.75 | — | — | |
| SCHEMBL10774827 | 0.75 | — | — | |
| SCHEMBL8780056 | 0.75 | — | — | |
| SCHEMBL29026122 | 0.75 | — | — | |
| SCHEMBL22899526 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-8217771-A | — | — | None | — | — | JP | disclosed |
| CN-114230588-A | Binary electrolyte and preparation and application thereof | 北京卫蓝新能源科技有限公司 | 2022-03-25 | — | — | CN | disclosed |
| CN-110981270-B | Gypsum powder additive and microwave radiation preparation method | 乌鲁木齐久久兴新材料有限公司 | 2021-09-24 | — | — | CN | disclosed |
| CN-110981270-A | Gypsum powder additive and microwave radiation preparation method | 乌鲁木齐久久兴新材料有限公司 | 2020-04-10 | — | — | CN | disclosed |
| JP-H08217771-A | PRODUCTION OF 3-METHYLTETRAHYDROFURAN | MITSUBISHI GAS CHEM CO INC | 1996-08-27 | — | — | JP | disclosed |