⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28968597 | 0.86 | — | — | |
| SCHEMBL28968586 | 0.85 | DNM1 (0.41) | — | |
| SCHEMBL3847687 | 0.75 | FNTA (0.36) | — | |
| SCHEMBL291060 | 0.75 | FNTA (0.36) | — | |
| Hydrogen Sulfide SCHEMBL8505278 | 0.74 | FNTA (0.35) | — | |
| SCHEMBL2175544 | 0.74 | ALOX15 (0.31) | — | |
| SCHEMBL28968584 | 0.72 | DNM1 (0.42) | — | |
| SCHEMBL27452480 | 0.66 | ALDH1A1 (0.33) | — | |
| SCHEMBL27785403 | 0.66 | APOBEC3A (0.35) | — | |
| SCHEMBL28482019 | 0.64 | ALDH1A1 (0.42) | — |
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-115872661-A | Viscosity-reducing polycarboxylate superplasticizer and preparation method thereof | 科之杰新材料集团有限公司 | 2023-03-31 | — | — | CN | disclosed |
| CN-115806648-A | Polycarboxylate superplasticizer prepared from viscosity-reducing macromonomer and preparation method thereof | 科之杰新材料集团有限公司 | 2023-03-17 | — | — | CN | disclosed |