⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28338459 | 0.96 | LMNA (0.37) | — | |
| SCHEMBL27516876 | 0.96 | LMNA (0.37) | — | |
| SCHEMBL1357107 | 0.87 | — | — | |
| SCHEMBL1972782 | 0.85 | — | — | |
| SCHEMBL14469775 | 0.85 | — | — | |
| SCHEMBL2046129 | 0.84 | — | — | |
| SCHEMBL8529643 | 0.84 | THRB (0.50) | — | |
| SCHEMBL1357162 | 0.82 | — | — | |
| SCHEMBL28687482 | 0.82 | TSHR (0.33) | — | |
| SCHEMBL20755802 | 0.80 | — | — |
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-116640361-B | Release agent composition and application thereof | 益丰新材料股份有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-117186057-A | Polythiol composition and application thereof | 益丰新材料股份有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-116640361-A | Release agent composition and application thereof | 益丰新材料股份有限公司 | 2023-08-25 | — | — | CN | disclosed |