⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7180242 | 0.86 | NQO1 (0.38) | — | |
| SCHEMBL10340654 | 0.83 | THRB (0.36) | — | |
| SCHEMBL5707376 | 0.80 | KCNA3 (0.46) | — | |
| SCHEMBL757706 | 0.77 | MMP2 (0.35) | — | |
| SCHEMBL8373718 | 0.77 | CHRNA7 (0.47) | — | |
| SCHEMBL482465 | 0.76 | CA12 (0.48) | — | |
| SCHEMBL23466928 | 0.74 | THRB (0.50) | — | |
| SCHEMBL6538593 | 0.73 | KCNA3 (0.48) | — | |
| SCHEMBL920853 | 0.72 | ALDH1A1 (0.43) | — | |
| SCHEMBL1506473 | 0.72 | ALDH1A1 (0.45) | — |
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-1630602-A2 | Polymerizable composition, hydrophilic film formed by curing said composition and planographic printing plate precursor | FUJI PHOTO FILM CO., LTD. (JP) | 2006-03-01 | — | — | EP | disclosed |