⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9256550 | 0.75 | SLC6A2 (0.42) | — | |
| SCHEMBL8846159 | 0.74 | HAO1 (0.33) | — | |
| SCHEMBL9257931 | 0.71 | — | — | |
| SCHEMBL9430217 | 0.71 | — | — | |
| SCHEMBL24737326 | 0.70 | SLC6A2 (0.43) | — | |
| SCHEMBL9567048 | 0.68 | TRPM8 (0.33) | — | |
| SCHEMBL9516818 | 0.66 | KDM1A (0.43) | — | |
| SCHEMBL9516824 | 0.66 | KDM1A (0.43) | — | |
| SCHEMBL9190928 | 0.65 | AKR1C3 (0.33) | — | |
| SCHEMBL8846207 | 0.65 | AKR1C3 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5459149-A | Penta-2,4-dienamides and use as pesticides | ROUSSEL UCLAF (FR) | 1995-10-17 | — | — | US | disclosed |
| US-5352822-A | Insecticides; miticides; nematocides | ROUSSEL UCLAF (FR) | 1994-10-04 | — | — | US | disclosed |
| US-5270343-A | Penta-2,4-dienamides and use as pesticides | ROUSSEL UCLAF (FR) | 1993-12-14 | — | — | US | disclosed |