⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL791884 | 0.97 | — | — | |
| SCHEMBL29985512 | 0.97 | GABRR1 (0.50) | — | |
| SCHEMBL11031932 | 0.97 | GABRR1 (0.50) | — | |
| SCHEMBL188004 | 0.97 | — | — | |
| SCHEMBL61073 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL2336239 | 0.94 | — | — | |
| SCHEMBL17630443 | 0.94 | — | — | |
| SCHEMBL17630445 | 0.94 | — | — | |
| SCHEMBL17631226 | 0.94 | — | — | |
| SCHEMBL28177763 | 0.94 | — | — |
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-109476811-A | One-part low temperature cure coating formed via a dual layer cure mechanism | 巴斯夫涂料有限公司 | 2019-03-15 | — | — | CN | disclosed |