⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL218286 | 0.97 | CYP1A2 (0.30) | — | |
| SCHEMBL27636435 | 0.94 | — | — | |
| SCHEMBL27276231 | 0.94 | — | — | |
| SCHEMBL27524839 | 0.94 | — | — | |
| SCHEMBL27568007 | 0.94 | — | — | |
| SCHEMBL28092180 | 0.94 | — | — | |
| SCHEMBL27464388 | 0.87 | — | — | |
| SCHEMBL27636308 | 0.87 | — | — | |
| SCHEMBL27497248 | 0.71 | GPR55 (0.33) | — | |
| SCHEMBL5076724 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109715682-B | Polymerization catalyst | 尤尼威蒂恩技术有限责任公司 | 2022-09-30 | — | — | CN | disclosed |
| CN-113748140-A | Metal-ligand complexes | 陶氏环球技术有限责任公司 | 2021-12-03 | — | — | CN | disclosed |
| CN-109715682-A | Polymerization catalyst | 尤尼威蒂恩技术有限责任公司 | 2019-05-03 | — | — | CN | disclosed |