⚠ 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 | |
|---|---|---|---|---|
| Imidazole SCHEMBL28412052 | 0.97 | — | — | |
| Imidazole SCHEMBL1130092 | 0.94 | — | — | |
| Imidazole SCHEMBL28846405 | 0.94 | — | — | |
| Imidazole SCHEMBL28061080 | 0.94 | — | — | |
| Imidazole SCHEMBL3503281 | 0.94 | ALDH1A1 (0.93) | — | |
| Imidazole SCHEMBL5317575 | 0.94 | ALDH1A1 (0.93) | — | |
| Imidazole SCHEMBL5333604 | 0.90 | ALDH1A1 (0.87) | — | |
| Imidazole SCHEMBL1445454 | 0.90 | — | — | |
| Imidazole SCHEMBL29154119 | 0.90 | — | — | |
| Imidazole SCHEMBL28066335 | 0.90 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111298832-B | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2022-11-18 | — | — | CN | claimed |
| CN-111298832-A | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2020-06-19 | — | — | CN | claimed |
| CN-117954643-B | Heteropoly acid-based nitrogen-doped carbon catalyst material, preparation method thereof and method for preparing zinc-air battery by using same | 淄博火炬能源有限责任公司 | 2024-07-16 | — | — | CN | disclosed |
| CN-117954643-A | Heteropoly acid-based nitrogen-doped carbon catalyst material, preparation method thereof and method for preparing zinc-air battery by using same | 淄博火炬能源有限责任公司 | 2024-04-30 | — | — | CN | disclosed |
| CN-111298832-B | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-111298832-B | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-111298832-B | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-111298832-A | Preparation method and application of imidazole phosphorus molybdenum vanadium-based ionic liquid material | 江苏大学 | 2020-06-19 | — | — | CN | disclosed |
| CN-107930688-A | The method that a kind of mesoporous supported imidazole ion liquid catalyst and catalysis oxidation alcohol prepare aldehydes or ketones | 三峡大学 | 2018-04-20 | — | — | CN | disclosed |