⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34976 | 0.87 | — | — | |
| SCHEMBL13725241 | 0.87 | — | — | |
| SCHEMBL28327958 | 0.87 | — | — | |
| SCHEMBL27813680 | 0.87 | — | — | |
| SCHEMBL6516836 | 0.75 | — | — | |
| SCHEMBL28741951 | 0.75 | — | — | |
| SCHEMBL28589685 | 0.75 | — | — | |
| SCHEMBL13724367 | 0.75 | — | — | |
| Water SCHEMBL31206563 | 0.75 | — | — | |
| SCHEMBL29785583 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110562917-B | Micro reforming device and micro reforming system | 翁幼云 | 2024-08-06 | — | — | CN | disclosed |
| CN-117282435-A | Hydrotalcite-like catalyst for preparing methanol by carbon dioxide hydrogenation and preparation method thereof | 浙江绿色智行科创有限公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-210885294-U | Micro reforming device and micro reforming system | 翁幼云 | 2020-06-30 | — | — | CN | disclosed |
| CN-105655612-A | Enclosed methanol-water steam reforming fuel cell hydrogen source system and hydrogen production method | 中国科学院大连化学物理研究所 | 2016-06-08 | — | — | CN | disclosed |