⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2713 | 0.96 | — | — | |
| Hydrogen Sulfide SCHEMBL27473260 | 0.92 | — | — | |
| SCHEMBL27680791 | 0.92 | — | — | |
| SCHEMBL27739507 | 0.92 | — | — | |
| SCHEMBL31187338 | 0.92 | — | — | |
| SCHEMBL28665933 | 0.92 | — | — | |
| SCHEMBL8762319 | 0.92 | — | — | |
| SCHEMBL27630704 | 0.92 | — | — | |
| SCHEMBL11380001 | 0.92 | — | — | |
| Fluoride SCHEMBL27834746 | 0.92 | — | — |
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-118047888-A | Ultra-high molecular weight polyethylene catalyst component, preparation method thereof and catalyst containing catalyst component | 中国石油天然气股份有限公司 | 2024-05-17 | — | — | CN | claimed |
| CN-101671432-A | 1, 2-propylene glycol modified polyethylene glycol terephthalate | WUJIANG YINGXIANG WANXIN CHEMI | 2010-03-17 | — | — | CN | claimed |
| CN-118047888-A | Ultra-high molecular weight polyethylene catalyst component, preparation method thereof and catalyst containing catalyst component | 中国石油天然气股份有限公司 | 2024-05-17 | — | — | CN | disclosed |
| CN-108162261-A | A kind of cleaning equipment of the mold of graphite polystyrene board | 安徽德全新型建材科技有限公司 | 2018-06-15 | — | — | CN | disclosed |
| CN-101671432-A | 1, 2-propylene glycol modified polyethylene glycol terephthalate | WUJIANG YINGXIANG WANXIN CHEMI | 2010-03-17 | — | — | CN | disclosed |