⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL63734 | 0.98 | TSHR (0.31) | — | |
| Propene SCHEMBL28314959 | 0.93 | TSHR (0.32) | — | |
| Acrylic Acid SCHEMBL1327373 | 0.93 | LMNA (0.34) | — | |
| SCHEMBL18260682 | 0.87 | — | — | |
| Methacrylic Acid SCHEMBL28836066 | 0.87 | — | — | |
| SCHEMBL2158899 | 0.86 | — | — | |
| SCHEMBL28477271 | 0.84 | — | — | |
| SCHEMBL41966 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL36391 | 0.81 | TSHR (0.31) | — | |
| SCHEMBL29170963 | 0.81 | TSHR (0.58) | — |
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-112266681-B | High-performance soap-free fluorosilicone acrylic latex paint and preparation method thereof | 浙江大学衢州研究院 | 2022-04-15 | — | — | CN | disclosed |
| CN-112266681-A | High-performance soap-free fluorosilicone acrylic latex paint and preparation method thereof | 浙江大学衢州研究院 | 2021-01-26 | — | — | CN | disclosed |