⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10028811 | 0.76 | MMP2 (0.33) | — | |
| SCHEMBL11924598 | 0.68 | — | — | |
| SCHEMBL15724616 | 0.66 | ALOX5 (0.33) | — | |
| SCHEMBL15724620 | 0.65 | PPARA (0.32) | — | |
| SCHEMBL15724623 | 0.65 | PPARA (0.32) | — | |
| SCHEMBL19889668 | 0.65 | — | — | |
| SCHEMBL15724566 | 0.65 | — | — | |
| SCHEMBL11924949 | 0.64 | — | — | |
| SCHEMBL11924942 | 0.64 | — | — | |
| SCHEMBL11924898 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230301185-A1 | COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT USING SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2023-09-21 | — | — | US | disclosed |