⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3266202 | 0.94 | — | — | |
| SCHEMBL2908299 | 0.89 | — | — | |
| SCHEMBL4798792 | 0.89 | — | — | |
| SCHEMBL419422 | 0.86 | — | — | |
| SCHEMBL923192 | 0.86 | — | — | |
| SCHEMBL1886006 | 0.86 | — | — | |
| SCHEMBL15053253 | 0.84 | — | — | |
| SCHEMBL16767003 | 0.81 | — | — | |
| SCHEMBL14914486 | 0.78 | BBOX1 (0.40) | — | |
| SCHEMBL14915157 | 0.76 | LMNA (0.39) | — |
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-115279493-B | Toluene disproportionation using enhanced UZM-39 aluminosilicate zeolite | 环球油品有限责任公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-115279493-A | Toluene disproportionation using enhanced UZM-39 aluminosilicate zeolite | 环球油品有限责任公司 | 2022-11-01 | — | — | CN | disclosed |