⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28292287 | 0.89 | — | — | |
| SCHEMBL27912157 | 0.89 | — | — | |
| SCHEMBL28184800 | 0.89 | — | — | |
| SCHEMBL28581062 | 0.89 | — | — | |
| SCHEMBL17473974 | 0.89 | — | — | |
| SCHEMBL2203849 | 0.87 | — | — | |
| SCHEMBL28577414 | 0.87 | — | — | |
| SCHEMBL27854191 | 0.87 | — | — | |
| SCHEMBL27846047 | 0.87 | — | — | |
| SCHEMBL28581060 | 0.82 | — | — |
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-110393621-A | A kind of fixed device of intrauterine device | WUJIANG YONGYUAN BIOLOGICAL SCIENCE & TECH CO LTD | 2019-11-01 | — | — | CN | disclosed |
| CN-109763046-A | A kind of high-strength and high-plasticity magnesium zinc-manganese tin calcium alloy and preparation method thereof | 重庆大学 | 2019-05-17 | — | — | CN | disclosed |