⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24851075 | 0.88 | ATM (0.31) | — | |
| SCHEMBL13845362 | 0.83 | CYP1A2 (0.33) | — | |
| SCHEMBL24612661 | 0.78 | — | — | |
| SCHEMBL24850969 | 0.77 | — | — | |
| SCHEMBL23638909 | 0.76 | CYP1A2 (0.30) | — | |
| SCHEMBL20842399 | 0.75 | CYP2C9 (0.35) | — | |
| SCHEMBL21386026 | 0.75 | CYP2C9 (0.35) | — | |
| SCHEMBL13211846 | 0.74 | — | — | |
| SCHEMBL1826153 | 0.73 | ATM (0.41) | — | |
| SCHEMBL1826151 | 0.73 | ATM (0.41) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4116381-A1 | METHOD FOR PRODUCING INK COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2023-01-11 | — | — | EP | disclosed |