⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1392461 | 0.74 | — | — | |
| SCHEMBL2254086 | 0.74 | — | — | |
| SCHEMBL1392488 | 0.74 | — | — | |
| SCHEMBL70608 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL232794 | 0.73 | ALDH1A1 (0.43) | — | |
| SCHEMBL535742 | 0.70 | ALDH1A1 (0.33) | — | |
| SCHEMBL11637160 | 0.70 | — | — | |
| SCHEMBL3150564 | 0.70 | CYP2A6 (0.38) | — | |
| SCHEMBL146326 | 0.70 | BACE1 (0.34) | — | |
| SCHEMBL2251309 | 0.69 | — | — |
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-0113252-B1 | PROCESS FOR PRODUCING BLOCK COPOLYAMIDE | TORAY INDUSTRIES, INC. (JP) | 1991-08-07 | — | — | EP | disclosed |
| US-4507465-A | IMPACT STRENGTH | TORAY INDUSTRIES, INC. (JP) | 1985-03-26 | — | — | US | disclosed |