⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19439609 | 0.76 | PNMT (0.38) | — | |
| SCHEMBL25028188 | 0.72 | PGR (0.39) | — | |
| SCHEMBL26500259 | 0.72 | — | — | |
| SCHEMBL26500298 | 0.70 | ESR1 (0.33) | — | |
| SCHEMBL26500266 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL26500279 | 0.69 | CYP19A1 (0.39) | — | |
| SCHEMBL26500300 | 0.69 | — | — | |
| SCHEMBL26503081 | 0.69 | PGR (0.37) | — | |
| SCHEMBL26500294 | 0.68 | DCK (0.34) | — | |
| SCHEMBL26500308 | 0.68 | RIPK2 (0.32) | — |
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-20230132579-A1 | PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, OPTICAL SENSOR, AND COMPOUND | FUJIFILM CORPORATION (JP) | 2023-05-04 | — | — | US | disclosed |