⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16504611 | 1.00 | — | — | |
| SCHEMBL373093 | 1.00 | — | — | |
| SCHEMBL28396878 | 1.00 | — | — | |
| SCHEMBL1667269 | 0.98 | ALDH1A1 (0.31) | — | |
| SCHEMBL8659597 | 0.95 | — | — | |
| SCHEMBL18260685 | 0.95 | ALDH1A1 (0.31) | — | |
| SCHEMBL2784845 | 0.91 | — | — | |
| Methacrylic Acid SCHEMBL29074444 | 0.91 | ALDH1A1 (0.38) | — | |
| SCHEMBL712582 | 0.91 | ALDH1A1 (0.31) | — | |
| SCHEMBL2957657 | 0.91 | ALDH1A1 (0.31) | — |
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-1033125-B1 | Relining material for dentures | KURARAY CO (JP) | 2003-09-24 | — | — | EP | disclosed |
| US-6410612-B1 | ACRYLIC POLYMER BLEND | KURARAY CO., LTD. (JP) | 2002-06-25 | — | — | US | disclosed |
| EP-1033125-A1 | Relining material for dentures | KURARAY CO., LTD. (JP) | 2000-09-06 | — | — | EP | disclosed |