⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8650710 | 0.73 | — | — | |
| SCHEMBL31388684 | 0.70 | — | — | |
| SCHEMBL11138267 | 0.66 | — | — | |
| SCHEMBL27658512 | 0.64 | — | — | |
| SCHEMBL27629055 | 0.64 | — | — | |
| SCHEMBL9876093 | 0.61 | — | — | |
| SCHEMBL19183339 | 0.60 | — | — | |
| SCHEMBL25242363 | 0.60 | — | — | |
| SCHEMBL27593578 | 0.59 | — | — | |
| SCHEMBL2926606 | 0.59 | — | — |
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-109369830-A | Solid activating agent system and preparation method thereof | 亚培烯科技（杭州）有限公司 | 2019-02-22 | — | — | CN | disclosed |
| CN-103102998-B | Fuel additive for improved performance of direct fuel injected engines | AFTON CHEMICAL CORP | 2015-07-15 | — | — | CN | disclosed |