⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19428195 | 0.92 | — | — | |
| SCHEMBL27315228 | 0.92 | — | — | |
| Bromide SCHEMBL27681667 | 0.90 | — | — | |
| Water SCHEMBL28170254 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL27266029 | 0.90 | — | — | |
| SCHEMBL7434852 | 0.90 | TSHR (0.32) | — | |
| Fluoride SCHEMBL27553092 | 0.90 | — | — | |
| SCHEMBL27260024 | 0.90 | — | — | |
| SCHEMBL27512116 | 0.90 | — | — | |
| Phosphine SCHEMBL27474794 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1027692-C | Process for producing dienamide derivative | ROUSSEL UCLAF CO (FR) | 1995-02-22 | — | — | CN | disclosed |
| CN-1091423-A | The pesticide composition that contains derivative of diene amide | WELLCOME FOUND (GB) | 1994-08-31 | — | — | CN | disclosed |
| CN-1045576-A | Pesticide | WELLCOME FOUND (GB) | 1990-09-26 | — | — | CN | disclosed |