⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1482684 | 0.74 | — | — | |
| SCHEMBL9419987 | 0.71 | — | — | |
| SCHEMBL28008368 | 0.69 | — | — | |
| SCHEMBL84277 | 0.67 | — | — | |
| SCHEMBL27357293 | 0.67 | — | — | |
| SCHEMBL3383717 | 0.67 | — | — | |
| SCHEMBL9388362 | 0.65 | — | — | |
| SCHEMBL7633930 | 0.65 | TSHR (0.32) | — | |
| SCHEMBL3317969 | 0.65 | — | — | |
| SCHEMBL10458781 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117580908-A | Curable composition, cured product, coating agent, and concrete structure | 株式会社钟化 | 2024-02-20 | — | — | CN | disclosed |
| CN-108368268-B | Titanium complexes as sulfidation catalysts | 汉高股份有限及两合公司 | 2021-03-19 | — | — | CN | disclosed |
| CN-107207870-B | Curable composition and cured product thereof | 株式会社钟化 | 2020-06-23 | — | — | CN | disclosed |
| CN-106414648-B | Titanium complexes as sulfidation catalysts | 汉高股份有限及两合公司 | 2020-02-07 | — | — | CN | disclosed |