⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL251821 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL27847815 | 0.81 | — | — | |
| SCHEMBL27349523 | 0.78 | PI4KA (0.33) | — | |
| SCHEMBL2605832 | 0.78 | — | — | |
| Methylamine SCHEMBL28946233 | 0.77 | NOS3 (0.31) | — | |
| SCHEMBL1542351 | 0.75 | KCNH2 (0.42) | — | |
| Cyanide SCHEMBL29895314 | 0.74 | HSP90AA1 (0.35) | — | |
| SCHEMBL3420486 | 0.74 | KDM4E (0.33) | — | |
| SCHEMBL8766240 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL27863632 | 0.72 | KDM4E (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11566140-B2 | Exterior coating composition | TROY CORPORATION (US) | 2023-01-31 | — | — | US | disclosed |
| US-20200377738-A1 | EXTERIOR COATING COMPOSITION | TROY CORPORATION (US) | 2020-12-03 | — | — | US | disclosed |