⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22834244 | 0.73 | TSHR (0.38) | — | |
| SCHEMBL1193790 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL4742771 | 0.71 | — | — | |
| SCHEMBL11213921 | 0.71 | — | — | |
| SCHEMBL1947040 | 0.71 | — | — | |
| SCHEMBL27834543 | 0.69 | F2 (0.37) | — | |
| SCHEMBL1903522 | 0.69 | — | — | |
| SCHEMBL2305166 | 0.69 | — | — | |
| SCHEMBL11171838 | 0.69 | — | — | |
| SCHEMBL27752447 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023171697-A1 | PRODUCTION METHOD FOR FLUORINE-CONTAINING COMPOUND | ＡＧＣ株式会社 | 2023-09-14 | — | — | WO | disclosed |
| CN-116621739-A | Preparation method of binary fluorine-containing sulfimide alkali metal salt and application of alkali metal salt | 珠海市赛纬电子材料股份有限公司 | 2023-08-22 | — | — | CN | disclosed |
| WO-2021060277-A1 | AMINATING AGENT AND METHOD FOR PRODUCING AMINATED PRODUCT | ＡＧＣ株式会社 | 2021-04-01 | — | — | WO | disclosed |