⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27976722 | 0.98 | — | — | |
| SCHEMBL29089106 | 0.95 | — | — | |
| SCHEMBL28372674 | 0.95 | — | — | |
| Phosphine SCHEMBL28867302 | 0.95 | — | — | |
| SCHEMBL18527030 | 0.95 | — | — | |
| Benzene SCHEMBL28812720 | 0.95 | — | — | |
| SCHEMBL3921585 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28961076 | 0.95 | — | — | |
| Selenium SCHEMBL3918987 | 0.95 | — | — | |
| SCHEMBL28367749 | 0.95 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116063998-B | Aluminum-based plugging anti-collapse agent and preparation method and application thereof | 中国石油天然气集团有限公司 | 2024-05-14 | — | — | CN | disclosed |
| WO-2023147626-A1 | PROCESSES AND CATALYSTS FOR DEHYDRATION OF SUGARS | BIOBASE FUTURE PTY LTD (AU) | 2023-08-10 | — | — | WO | disclosed |
| CN-116063998-A | Aluminum-based plugging anti-collapse agent and preparation method and application thereof | 中国石油天然气集团有限公司 | 2023-05-05 | — | — | CN | disclosed |