⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6579071 | 0.93 | — | — | |
| SCHEMBL3810238 | 0.89 | LMNA (0.33) | — | |
| SCHEMBL29130316 | 0.85 | LMNA (0.38) | — | |
| SCHEMBL27035528 | 0.85 | LMNA (0.38) | — | |
| SCHEMBL28543858 | 0.85 | DNM1 (0.35) | — | |
| Hydroxyl Radical SCHEMBL28836014 | 0.84 | DNM1 (0.38) | — | |
| Ethylenediamine SCHEMBL450007 | 0.84 | LMNA (0.37) | — | |
| SCHEMBL2321144 | 0.83 | — | — | |
| SCHEMBL2828097 | 0.83 | LMNA (0.37) | — | |
| Ammonia Solution, Strong SCHEMBL27896209 | 0.83 | DNM1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116686098-A | Barrier assembly for solar cells | 3M创新有限公司 | 2023-09-01 | — | — | CN | disclosed |