⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10178788 | 0.83 | HMGCR (0.31) | — | |
| SCHEMBL16591077 | 0.80 | HMGCR (0.31) | — | |
| SCHEMBL13344908 | 0.74 | — | — | |
| SCHEMBL12009262 | 0.72 | — | — | |
| SCHEMBL12009277 | 0.65 | — | — | |
| SCHEMBL5697624 | 0.64 | EPHX2 (0.39) | — | |
| SCHEMBL30663525 | 0.64 | ABCB1 (0.30) | — | |
| SCHEMBL5568688 | 0.63 | MEN1 (0.35) | — | |
| SCHEMBL10178832 | 0.63 | HMGCR (0.35) | — | |
| SCHEMBL5568128 | 0.62 | MAPK1 (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3037880-A1 | LAMINATE BODY | Fujifilm Corporation (JP) | 2016-06-29 | — | — | EP | disclosed |