⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23701196 | 0.83 | TSHR (0.50) | — | |
| SCHEMBL23700975 | 0.81 | TSHR (0.50) | — | |
| SCHEMBL14956658 | 0.81 | TSHR (0.35) | — | |
| SCHEMBL26666772 | 0.80 | TSHR (0.50) | — | |
| SCHEMBL4213071 | 0.80 | TSHR (0.43) | — | |
| SCHEMBL4207608 | 0.74 | TSHR (0.43) | — | |
| SCHEMBL4218097 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL4210454 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL4199318 | 0.73 | TSHR (0.33) | — | |
| SCHEMBL8636105 | 0.72 | — | — |
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-114716599-B | Olefin copolymer and preparation method and application thereof | 中国石油化工股份有限公司 | 2024-02-13 | — | — | CN | disclosed |
| US-11807758-B2 | Siloxane polymer and method of producing siloxane polymer | JNC CORPORATION (JP) | 2023-11-07 | — | — | US | disclosed |
| CN-114716599-A | Olefin copolymer and preparation method and application thereof | 中国石油化工股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| US-20210238419-A1 | SILOXANE POLYMER AND METHOD OF PRODUCING SILOXANE POLYMER | JNC CORPORATION (JP) | 2021-08-05 | — | — | US | disclosed |