⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30006426 | 0.84 | TDP1 (0.39) | — | |
| SCHEMBL11367820 | 0.79 | — | — | |
| SCHEMBL7591047 | 0.77 | — | — | |
| SCHEMBL14481182 | 0.77 | HSD17B10 (0.33) | — | |
| SCHEMBL1258831 | 0.77 | — | — | |
| SCHEMBL31475713 | 0.77 | — | — | |
| SCHEMBL14481003 | 0.77 | HSD17B10 (0.33) | — | |
| SCHEMBL13537950 | 0.74 | — | — | |
| SCHEMBL28346957 | 0.74 | — | — | |
| SCHEMBL27691025 | 0.74 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230250218-A1 | URETHANE COMPOSITION | NITTO KASEI CO., LTD. (JP) | 2023-08-10 | — | — | US | disclosed |
| EP-4198068-A1 | URETHANE COMPOSITION | Nitto Kasei Co., Ltd. (JP) | 2023-06-21 | — | — | EP | disclosed |
| CN-116018365-A | Carbamate composition | 日东化成株式会社 | 2023-04-25 | — | — | CN | disclosed |