⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2357386 | 0.78 | CYP1A2 (0.33) | — | |
| SCHEMBL16077751 | 0.76 | ALDH1A1 (0.32) | — | |
| SCHEMBL5390040 | 0.75 | CYP4F2 (0.32) | — | |
| SCHEMBL14777643 | 0.70 | TSHR (0.31) | — | |
| SCHEMBL16202369 | 0.70 | — | — | |
| SCHEMBL16077758 | 0.70 | ALDH1A1 (0.34) | — | |
| SCHEMBL14778541 | 0.69 | MEN1 (0.30) | — | |
| SCHEMBL14476936 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL14778597 | 0.69 | MEN1 (0.30) | — | |
| SCHEMBL14777772 | 0.69 | MEN1 (0.30) | — |
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-3605228-A1 | RADIATION SENSITIVE COMPOSITION AND RESIST PATTERN FORMING METHOD | JSR Corporation (JP) | 2020-02-05 | — | — | EP | disclosed |