⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL672452 | 0.88 | — | — | |
| SCHEMBL28739386 | 0.88 | LMNA (0.43) | — | |
| SCHEMBL1157713 | 0.84 | LMNA (0.40) | — | |
| Acrylic Acid SCHEMBL26659299 | 0.74 | — | — | |
| SCHEMBL30642013 | 0.74 | — | — | |
| SCHEMBL28890301 | 0.69 | — | — | |
| SCHEMBL2582289 | 0.68 | — | — | |
| SCHEMBL34846 | 0.68 | — | — | |
| SCHEMBL27790656 | 0.68 | — | — | |
| SCHEMBL406223 | 0.67 | — | — |
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-113831269-B | Synthesis method of vinyl dithiocarbamate compound | 台州学院 | 2023-04-07 | — | — | CN | disclosed |
| CN-113831269-A | Synthesis method of vinyl dithiocarbamate compound | 台州学院 | 2021-12-24 | — | — | CN | disclosed |