⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL893661 | 0.98 | — | — | |
| SCHEMBL8626318 | 0.64 | — | — | |
| SCHEMBL541939 | 0.62 | — | — | |
| SCHEMBL13785021 | 0.62 | — | — | |
| SCHEMBL967961 | 0.61 | — | — | |
| SCHEMBL11043539 | 0.60 | ALDH1A1 (0.33) | — | |
| SCHEMBL22200091 | 0.53 | MAPT (0.56) | — | |
| Maleic Anhydride SCHEMBL419946 | 0.52 | KMT2A (0.32) | — | |
| Maleic Anhydride SCHEMBL28247 | 0.52 | KMT2A (0.32) | — | |
| Maleic Anhydride SCHEMBL11037404 | 0.50 | KMT2A (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0206544-B1 | INSTANTANEOUSLY CURABLE COMPOSITION | Nippon Paint Co., Ltd. (JP) | 1992-01-08 | — | — | EP | disclosed |
| EP-0206544-A2 | Instantaneously curable composition | Nippon Paint Co., Ltd. (JP) | 1986-12-30 | — | — | EP | disclosed |