⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27739877 | 0.85 | FDPS (0.60) | — | |
| SCHEMBL9493001 | 0.83 | FDPS (0.61) | — | |
| SCHEMBL22118868 | 0.81 | — | — | |
| SCHEMBL28164723 | 0.80 | FDPS (0.46) | — | |
| SCHEMBL2020128 | 0.78 | — | — | |
| SCHEMBL2150591 | 0.76 | — | — | |
| SCHEMBL4095556 | 0.72 | FDPS (1.00) | — | |
| SCHEMBL3889795 | 0.72 | FDPS (0.62) | — | |
| SCHEMBL2150504 | 0.72 | TYMS (0.39) | — | |
| SCHEMBL14763893 | 0.70 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5277788-A | Twice-anodized aluminum article having an organo-phosphorus monolayer and process for making the article | ALUMINUM COMPANY OF AMERICA (US) | 1994-01-11 | — | — | US | claimed |
| CN-118055676-A | Hole transport material, application thereof, solar cell and preparation method thereof | 天合光能股份有限公司 | 2024-05-17 | — | — | CN | disclosed |
| US-5277788-A | Twice-anodized aluminum article having an organo-phosphorus monolayer and process for making the article | ALUMINUM COMPANY OF AMERICA (US) | 1994-01-11 | — | — | US | disclosed |