⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10070537 | 0.91 | — | — | |
| SCHEMBL13328560 | 0.89 | — | — | |
| SCHEMBL13939248 | 0.86 | KDM4E (0.31) | — | |
| SCHEMBL13939246 | 0.85 | KDM4E (0.31) | — | |
| SCHEMBL12336017 | 0.84 | ALDH1A1 (0.35) | — | |
| SCHEMBL13939252 | 0.83 | GPX4 (0.30) | — | |
| SCHEMBL13328222 | 0.83 | — | — | |
| SCHEMBL13939253 | 0.82 | — | — | |
| SCHEMBL443886 | 0.80 | KDM4E (0.34) | — | |
| SCHEMBL13328133 | 0.78 | GPX4 (0.35) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120009527-A1 | PATTERNING PROCESS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2012-01-12 | — | — | US | disclosed |
| US-20100159392-A1 | PATTERNING PROCESS AND RESIST COMPOSITION | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2010-06-24 | — | — | US | disclosed |