⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28522026 | 0.81 | TDP2 (0.31) | — | |
| SCHEMBL28066341 | 0.81 | — | — | |
| SCHEMBL28522028 | 0.81 | — | — | |
| SCHEMBL11231105 | 0.81 | MAPT (0.31) | — | |
| SCHEMBL28650388 | 0.79 | SETD7 (0.31) | — | |
| SCHEMBL28897961 | 0.77 | CES1 (0.31) | — | |
| Phosphoric Acid SCHEMBL27547149 | 0.74 | NPSR1 (0.32) | — | |
| SCHEMBL19834896 | 0.71 | ALDH1A1 (0.35) | — | |
| SCHEMBL20553971 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL27852135 | 0.69 | ALDH1A1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116917258-A | Compound, mixture, curable resin composition, and cured product thereof | 日本化药株式会社 | 2023-10-20 | — | — | CN | disclosed |
| CN-112105673-A | Aromatic amine resin having N-alkyl group, curable resin composition, and cured product thereof | 日本化药株式会社 | 2020-12-18 | — | — | CN | disclosed |