⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1616586 | 0.75 | — | — | |
| SCHEMBL853743 | 0.70 | — | — | |
| SCHEMBL7154176 | 0.70 | — | — | |
| SCHEMBL11109724 | 0.67 | TDP1 (0.33) | — | |
| SCHEMBL6759580 | 0.67 | — | — | |
| SCHEMBL9694429 | 0.66 | — | — | |
| SCHEMBL10788395 | 0.65 | — | — | |
| SCHEMBL3436949 | 0.65 | — | — | |
| Butadiene Epoxide SCHEMBL335040 | 0.62 | — | — | |
| Butadiene Epoxide SCHEMBL39877 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-3993489-A | Multi-color laminate of photopolymer that is image-wise hydroperoxidized | MONSANTO COMPANY (US) | 1976-11-23 | — | — | US | disclosed |
| US-3992209-A | Imagewise distribution of sulfate group on substrate polymer by photographic techniques | MONSANTO COMPANY (US) | 1976-11-16 | — | — | US | disclosed |