⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2059055 | 0.83 | — | — | |
| SCHEMBL13488640 | 0.79 | — | — | |
| SCHEMBL19808357 | 0.77 | ESR1 (0.35) | — | |
| SCHEMBL28139669 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL16121808 | 0.73 | — | — | |
| SCHEMBL5830471 | 0.73 | ALDH1A1 (0.38) | — | |
| SCHEMBL12438194 | 0.73 | ALDH1A1 (0.38) | — | |
| SCHEMBL10038987 | 0.72 | — | — | |
| SCHEMBL6978844 | 0.72 | TSHR (0.36) | — | |
| SCHEMBL6979137 | 0.70 | — | — |
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-0617013-B1 | Copolymerisable oximethers and copolymers containing these | BASF AG (DE) | 1996-01-10 | — | — | EP | disclosed |
| US-5393904-A | Crosslinking; protective coatings, adhesives | BASF AKTIENGESELLSCHAFT (DE) | 1995-02-28 | — | — | US | disclosed |
| EP-0617013-A1 | Copolymerisable oximethers and copolymers containing these | BASF Aktiengesellschaft (DE) | 1994-09-28 | — | — | EP | disclosed |