⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7183751 | 0.85 | — | — | |
| SCHEMBL202629 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL3249862 | 0.77 | — | — | |
| SCHEMBL10411104 | 0.76 | — | — | |
| SCHEMBL4290452 | 0.73 | — | — | |
| SCHEMBL1674435 | 0.73 | — | — | |
| SCHEMBL24585263 | 0.73 | — | — | |
| SCHEMBL2552779 | 0.73 | — | — | |
| SCHEMBL2576168 | 0.72 | — | — | |
| SCHEMBL31485533 | 0.72 | DNM1 (0.30) | — |
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-104884552-B | The curable coating composition of one pack system, its preparation and application and coating prepared therefrom and product | 巴斯夫涂料有限公司 | 2018-09-14 | — | — | CN | disclosed |