⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29183162 | 0.88 | — | — | |
| SCHEMBL28100189 | 0.81 | — | — | |
| SCHEMBL28100447 | 0.79 | — | — | |
| SCHEMBL29936004 | 0.78 | — | — | |
| SCHEMBL29936162 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL3662154 | 0.74 | — | — | |
| SCHEMBL28132696 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL28104111 | 0.72 | — | — | |
| SCHEMBL1843724 | 0.72 | — | — | |
| SCHEMBL2125915 | 0.72 | — | — |
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-113056584-B | Fiber bundling agent, fiber material, molding material, and molded article | DIC株式会社 | 2023-06-09 | — | — | CN | disclosed |
| CN-116194533-A | Aqueous epoxy resin composition, fiber bundling agent, fiber bundle, molding material and molded article | DIC株式会社 | 2023-05-30 | — | — | CN | disclosed |