⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28090946 | 0.79 | CRBN (0.53) | — | |
| SCHEMBL28274481 | 0.77 | — | — | |
| SCHEMBL8005600 | 0.77 | TDP1 (0.36) | — | |
| SCHEMBL203009 | 0.77 | — | — | |
| SCHEMBL13983646 | 0.77 | — | — | |
| SCHEMBL5960497 | 0.75 | KDM5B (0.36) | — | |
| SCHEMBL28740940 | 0.73 | — | — | |
| SCHEMBL28627745 | 0.73 | TSHR (0.41) | — | |
| SCHEMBL8005670 | 0.73 | — | — | |
| Formaldehyde SCHEMBL27917370 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1008055-B | PESTICIDE COMPOSITION WITH ACRYLIC DERIVS. AS ACTIVE COMPONENT AND PROCESS FOR PREPARING SAME, AND USE THEREOF | ICI PLC (GB) | 1990-05-23 | — | — | CN | disclosed |
| CN-85108235-A | The preparation of sterilant | — | 1986-08-27 | — | — | CN | disclosed |