⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12166551 | 0.74 | SHBG (0.30) | — | |
| SCHEMBL7885821 | 0.72 | GAA (0.31) | — | |
| SCHEMBL22905106 | 0.69 | — | — | |
| SCHEMBL2532860 | 0.64 | — | — | |
| SCHEMBL11146731 | 0.63 | GPBAR1 (0.32) | — | |
| SCHEMBL28845544 | 0.62 | SHBG (0.32) | — | |
| SCHEMBL27513169 | 0.61 | SHBG (0.33) | — | |
| SCHEMBL24505890 | 0.59 | — | — | |
| SCHEMBL8202365 | 0.59 | SHBG (0.30) | — | |
| SCHEMBL7891972 | 0.59 | — | — |
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-3112178-B1 | ON-MACHINE DEVELOPMENT TYPE LITHOGRAPHIC PRINTING PLATE PRECURSOR PROCESSING METHOD AND PRINTING METHOD | FUJIFILM CORP (JP) | 2018-05-16 | — | — | EP | disclosed |