⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL197236 | 0.82 | — | — | |
| Barium SCHEMBL29787051 | 0.82 | — | — | |
| Barium SCHEMBL29397276 | 0.82 | — | — | |
| Barium SCHEMBL31016513 | 0.67 | — | — | |
| SCHEMBL29010129 | 0.67 | — | — | |
| Water SCHEMBL21810573 | 0.67 | — | — | |
| SCHEMBL19714689 | 0.67 | — | — | |
| Barium SCHEMBL31084207 | 0.67 | — | — | |
| SCHEMBL8984148 | 0.67 | — | — | |
| SCHEMBL30254716 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230201225-A1 | METHODS OF TREATING MULTIPLE SCLEROSIS | REPRISE PHARMACEUTICALS INC (US) | 2023-06-29 | — | — | US | claimed |
| US-20230099229-A1 | METHODS OF TREATING MULTIPLE SCLEROSIS | REPRISE PHARMACEUTICALS INC (US) | 2023-03-30 | — | — | US | claimed |
| EP-4117785-A1 | METHODS OF TREATING MULTIPLE SCLEROSIS | Simard, Marc J. (US) | 2023-01-18 | — | — | EP | claimed |
| CN-116458423-B | Application of exogenous melatonin in improving heat resistance of Chinese cabbage and relieving high-temperature bitter of Chinese cabbage | 浙江大学 | 2024-06-21 | — | — | CN | disclosed |
| CN-116458423-A | Application of exogenous melatonin in improving heat resistance of Chinese cabbage and relieving high-temperature bitter of Chinese cabbage | 浙江大学 | 2023-07-21 | — | — | CN | disclosed |
| US-20230201225-A1 | METHODS OF TREATING MULTIPLE SCLEROSIS | REPRISE PHARMACEUTICALS INC (US) | 2023-06-29 | — | — | US | disclosed |
| US-20230099229-A1 | METHODS OF TREATING MULTIPLE SCLEROSIS | REPRISE PHARMACEUTICALS INC (US) | 2023-03-30 | — | — | US | disclosed |
| CN-114335568-A | Composite electrode material with low thermal expansion coefficient, preparation method and application | 国家能源集团新能源有限责任公司 | 2022-04-12 | — | — | CN | disclosed |