⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9430507 | 1.00 | — | — | |
| SCHEMBL9430441 | 1.00 | — | — | |
| SCHEMBL9580591 | 1.00 | — | — | |
| SCHEMBL9580479 | 0.87 | PYGL (0.32) | — | |
| SCHEMBL9580471 | 0.87 | HPGD (0.32) | — | |
| SCHEMBL9258443 | 0.82 | RXRA (0.36) | — | |
| SCHEMBL9191180 | 0.81 | NPC1 (0.34) | — | |
| SCHEMBL9516860 | 0.80 | RXRA (0.36) | — | |
| SCHEMBL9580557 | 0.80 | RXRA (0.36) | — | |
| SCHEMBL9516853 | 0.80 | RXRA (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5345750-A | — | — | None | — | — | JP | disclosed |
| JP-H05345750-A | EXPELLING AGENT AGAINST HARMFUL ORGANISMS | ROUSSEL UCLAF | 1993-12-27 | — | — | JP | disclosed |