⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11096091 | 0.76 | TDP1 (0.33) | — | |
| SCHEMBL11096200 | 0.76 | TDP1 (0.33) | — | |
| SCHEMBL11095958 | 0.76 | TDP1 (0.33) | — | |
| SCHEMBL11099118 | 0.73 | TDP1 (0.31) | — | |
| SCHEMBL11093533 | 0.73 | TDP1 (0.31) | — | |
| SCHEMBL11097205 | 0.73 | TDP1 (0.31) | — | |
| SCHEMBL8781208 | 0.71 | TDP1 (0.36) | — | |
| SCHEMBL11060245 | 0.68 | TDP1 (0.34) | — | |
| SCHEMBL11060249 | 0.68 | TDP1 (0.34) | — | |
| Methomyl SCHEMBL14012851 | 0.68 | TDP1 (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4454134-A | INSECTICIDES, MITICIDES | UNION CARBIDE CORPORATION (US) | 1984-06-12 | — | — | US | disclosed |