⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25090872 | 0.77 | — | — | |
| SCHEMBL29243792 | 0.77 | — | — | |
| SCHEMBL17729399 | 0.72 | PRMT1 (0.32) | — | |
| SCHEMBL20689516 | 0.69 | OPRL1 (0.32) | — | |
| SCHEMBL20689210 | 0.69 | OPRL1 (0.32) | — | |
| SCHEMBL31266672 | 0.69 | OPRL1 (0.32) | — | |
| SCHEMBL25090905 | 0.69 | SLC6A2 (0.43) | — | |
| SCHEMBL24423147 | 0.69 | SLC6A2 (0.43) | — | |
| SCHEMBL22294876 | 0.66 | ALDH1A1 (0.31) | — | |
| SCHEMBL5090272 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230062861-A1 | PPARg MODULATORS AND METHODS OF USE | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2023-03-02 | — | — | US | disclosed |
| WO-2022099144-A1 | ΡΡΑRγ MODULATORS AND METHODS OF USE | Eisai R&D Mangement Co., Ltd. (JP) | 2022-05-12 | — | — | WO | disclosed |