⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3670898 | 0.91 | — | — | |
| SCHEMBL5085518 | 0.85 | — | — | |
| SCHEMBL5088863 | 0.84 | — | — | |
| SCHEMBL5085825 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL5084626 | 0.79 | — | — | |
| SCHEMBL10591265 | 0.77 | — | — | |
| SCHEMBL3674791 | 0.74 | — | — | |
| SCHEMBL3673311 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL3670136 | 0.69 | — | — | |
| SCHEMBL5085517 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118900884-A | Rubber composition for heavy-duty tire | 瑞住合成橡胶株式会社 | 2024-11-05 | — | — | CN | disclosed |
| CN-116194306-A | Rubber composition for heavy-duty tire | 瑞住合成橡胶株式会社 | 2023-05-30 | — | — | CN | disclosed |
| WO-2022071130-A1 | RUBBER COMPOSITION FOR HEAVY-LOAD TIRE | ＺＳエラストマー株式会社 | 2022-04-07 | — | — | WO | disclosed |
| WO-2008108377-A1 | CONJUGATED DIENE-BASED POLYMER, METHOD FOR MANUFACTURING THE SAME, AND CONJUGATED DIENE POLYMER COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2008-09-12 | — | — | WO | disclosed |
| EP-0341496-A2 | Modified diene polymer rubbers | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1989-11-15 | — | — | EP | disclosed |