⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34966 | 0.97 | — | — | |
| SCHEMBL195214 | 0.97 | — | — | |
| SCHEMBL30817329 | 0.97 | TSHR (0.38) | — | |
| SCHEMBL865963 | 0.97 | — | — | |
| SCHEMBL28259165 | 0.95 | — | — | |
| SCHEMBL28284465 | 0.95 | — | — | |
| SCHEMBL28122355 | 0.95 | — | — | |
| Ethylene SCHEMBL27439591 | 0.95 | TSHR (0.37) | — | |
| Ethylene Glycol SCHEMBL9234317 | 0.89 | TSHR (0.45) | — | |
| Carbamic Acid SCHEMBL20496119 | 0.89 | TSHR (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113388185-B | EVA foaming material and preparation method and application thereof | 厦门联合信诺新材料有限公司 | 2023-09-29 | — | — | CN | claimed |
| CN-110885540-A | PET composite material and preparation method and application thereof | 宁波华腾首研新材料有限公司 | 2020-03-17 | — | — | CN | claimed |
| CN-110885540-A | PET composite material and preparation method and application thereof | 宁波华腾首研新材料有限公司 | 2020-03-17 | — | — | CN | disclosed |