⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8994466 | 0.84 | ALDH1A1 (0.33) | — | |
| SCHEMBL10692469 | 0.81 | THRB (0.33) | — | |
| SCHEMBL28981673 | 0.80 | MEN1 (0.32) | — | |
| SCHEMBL8418008 | 0.79 | THRB (0.32) | — | |
| SCHEMBL11105494 | 0.78 | ALDH1A1 (0.30) | — | |
| SCHEMBL10659611 | 0.77 | CYP3A4 (0.37) | — | |
| SCHEMBL7590082 | 0.77 | TSHR (0.30) | — | |
| SCHEMBL2801371 | 0.77 | — | — | |
| SCHEMBL27653201 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL26117826 | 0.74 | CYP3A4 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110300772-B | Polyoxazolidinones and process for their preparation | 巴斯夫欧洲公司 | 2022-04-26 | — | — | CN | disclosed |
| CN-112424253-A | Bulk polymerization of polyoxazolidinones | 巴斯夫欧洲公司 | 2021-02-26 | — | — | CN | disclosed |