⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20122754 | 0.98 | — | — | |
| SCHEMBL7771253 | 0.98 | — | — | |
| SCHEMBL29030080 | 0.95 | — | — | |
| SCHEMBL775803 | 0.78 | — | — | |
| SCHEMBL9786543 | 0.76 | — | — | |
| SCHEMBL29030267 | 0.76 | MEN1 (0.31) | — | |
| SCHEMBL7770937 | 0.73 | — | — | |
| SCHEMBL7771349 | 0.73 | — | — | |
| SCHEMBL38661147 | 0.73 | — | — | |
| SCHEMBL233054 | 0.73 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112724378-B | Fast-crystallization modified PET copolyester and preparation method thereof | 中国石油化工股份有限公司 | 2022-12-09 | — | — | CN | claimed |
| CN-112724378-A | Fast-crystallization modified PET copolyester and preparation method thereof | 中国石油化工股份有限公司 | 2021-04-30 | — | — | CN | claimed |
| CN-117512795-B | Small-particle-size probiotic microcapsule with high solid content and application thereof | 合肥芯能相变新材料科技有限公司 | 2024-04-30 | — | — | CN | disclosed |
| CN-117512795-A | Small-particle-size probiotic microcapsule with high solid content and application thereof | 合肥芯能相变新材料科技有限公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-112724378-B | Fast-crystallization modified PET copolyester and preparation method thereof | 中国石油化工股份有限公司 | 2022-12-09 | — | — | CN | disclosed |
| CN-113832749-A | Microcapsule printed fabric preparation method and device | 合肥芯能相变新材料科技有限公司 | 2021-12-24 | — | — | CN | disclosed |
| CN-112724378-A | Fast-crystallization modified PET copolyester and preparation method thereof | 中国石油化工股份有限公司 | 2021-04-30 | — | — | CN | disclosed |