⚠ 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 | |
|---|---|---|---|---|
| Butadiene SCHEMBL9579687 | 0.88 | TDP1 (0.75) | — | |
| SCHEMBL27716047 | 0.88 | — | — | |
| Propene SCHEMBL28161236 | 0.88 | — | — | |
| SCHEMBL5703612 | 0.88 | — | — | |
| SCHEMBL14870 | 0.87 | — | — | |
| SCHEMBL5708652 | 0.87 | TDP1 (1.00) | — | |
| SCHEMBL2128293 | 0.87 | TDP1 (1.00) | — | |
| Acrylamide SCHEMBL5199486 | 0.85 | TDP1 (0.71) | — | |
| Acrylamide SCHEMBL28724334 | 0.85 | TDP1 (0.71) | — | |
| Acrylamide SCHEMBL460343 | 0.85 | TDP1 (0.71) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110383171-A | Photosensitive resin composition for flexographic printing plate, flexographic printing original plate, flexographic printing plate and copolymer | 旭化成株式会社 | 2019-10-25 | — | — | CN | disclosed |