⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16842670 | 0.77 | ALOX5 (0.41) | — | |
| SCHEMBL13407748 | 0.76 | — | — | |
| SCHEMBL13274219 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL14388908 | 0.74 | — | — | |
| SCHEMBL172632 | 0.74 | — | — | |
| SCHEMBL16492187 | 0.74 | — | — | |
| SCHEMBL257119 | 0.74 | — | — | |
| SCHEMBL13274053 | 0.74 | MEN1 (0.42) | — | |
| SCHEMBL144611 | 0.70 | — | — | |
| SCHEMBL10186467 | 0.70 | ALOX5 (0.33) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022033548-A1 | IMMUNOREGULATORY COMPOUND AND ANTITUMOR APPLICATION THEREOF | 上海科技大学 | 2022-02-17 | — | — | WO | disclosed |
| WO-2021219078-A1 | HETEROCYCLE AND GLUTARIMIDE SKELETON-BASED COMPOUND AND APPLICATIONS THEREOF | 上海科技大学 (CN) | 2021-11-04 | — | — | WO | disclosed |
| WO-2017205309-A1 | INSULIN RECEPTOR PARTIAL AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2017-11-30 | — | — | WO | disclosed |
| WO-2015094970-A1 | MONO- AND DIALKYL ETHERS OF FURAN-2,5-DIMETHANOL AND (TETRA-HYDROFURAN-2,5-DIYL)DIMETHANOL AND AMPHIPHILIC DERIVATIVES THEREOF | ARCHER DANIELS MIDLAND COMPANY (US) | 2015-06-25 | — | — | WO | disclosed |