⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL16167399 | 0.98 | TBXAS1 (0.51) | — | |
| SCHEMBL1738515 | 0.94 | TBXAS1 (0.56) | — | |
| SCHEMBL1999912 | 0.86 | — | — | |
| SCHEMBL3431746 | 0.86 | TBXAS1 (0.66) | — | |
| SCHEMBL9777191 | 0.86 | TBXAS1 (0.60) | — | |
| Bromide SCHEMBL10788284 | 0.84 | — | — | |
| SCHEMBL28062565 | 0.84 | TBXAS1 (0.69) | — | |
| SCHEMBL503743 | 0.84 | TBXAS1 (0.69) | — | |
| SCHEMBL27220899 | 0.83 | TBXAS1 (0.53) | — | |
| SCHEMBL285224 | 0.81 | TERT (0.59) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113578380-B | Column [5] arene ionic liquid catalyst based on propylimidazole functionalization and preparation method thereof | 抚顺东科新能源科技有限公司 | 2022-07-22 | — | — | CN | disclosed |
| CN-113215400-B | Method for extracting metal ions by using ionic liquid compound | 苏州科技大学 | 2022-04-15 | — | — | CN | disclosed |
| CN-113578380-A | Column [5] arene ionic liquid catalyst based on propylimidazole functionalization and preparation method thereof | 辽宁东科药业有限公司 | 2021-11-02 | — | — | CN | disclosed |
| EP-2448926-A1 | FLAVIN DERIVATIVES | Biorelix, Inc. (US) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011008247-A1 | FLAVIN DERIVATIVES | BIORELIX, INC. (US) | 2011-01-20 | — | — | WO | disclosed |
| EP-0604409-A4 | COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION. | ISIS PHARMACEUTICALS INC (US) | 1996-06-12 | — | — | EP | disclosed |
| EP-0604409-A1 | COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION | ISIS PHARMACEUTICALS, INC. (US) | 1994-07-06 | — | — | EP | disclosed |
| WO-1991010671-A1 | COMPOSITIONS AND METHODS FOR DETECTING AND MODULATING RNA ACTIVITY AND GENE EXPRESSION | ISIS PHARMACEUTICALS, INC. (US) | 1991-07-25 | — | — | WO | disclosed |