⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10727764 | 0.98 | — | — | |
| SCHEMBL10727735 | 0.82 | — | — | |
| SCHEMBL1535073 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL30576694 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL29078047 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL9017027 | 0.74 | — | — | |
| SCHEMBL9306656 | 0.68 | — | — | |
| Acrylamide SCHEMBL6770534 | 0.67 | ALDH1A1 (0.46) | — | |
| Acrylamide SCHEMBL27789345 | 0.67 | ALDH1A1 (0.41) | — | |
| SCHEMBL6555692 | 0.66 | ELANE (0.37) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0442508-B1 | A process for making graft copolymers from lignin and vinyl monomers | MEISTER JOHN J (US) | 1996-12-27 | — | — | EP | claimed |
| US-5138007-A | Mixture with redox initiator and halide salt | MEISTER JOHN J (US) | 1992-08-11 | — | — | US | claimed |
| US-5138007-A | Mixture with redox initiator and halide salt | MEISTER JOHN J (US) | 1992-08-11 | — | — | US | disclosed |