⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11948914 | 0.91 | HMGCR (0.30) | — | |
| SCHEMBL106209 | 0.90 | — | — | |
| SCHEMBL11948916 | 0.89 | ALDH1A1 (0.30) | — | |
| SCHEMBL11948926 | 0.89 | EPHX2 (0.31) | — | |
| SCHEMBL11948932 | 0.88 | — | — | |
| SCHEMBL6367121 | 0.87 | CYP17A1 (0.31) | — | |
| SCHEMBL11948908 | 0.82 | ALDH1A1 (0.35) | — | |
| SCHEMBL11948921 | 0.81 | — | — | |
| SCHEMBL47472 | 0.81 | CYP17A1 (0.30) | — | |
| SCHEMBL47422 | 0.81 | CYP17A1 (0.41) | — |
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-8232039-B2 | Polymer and resist composition comprising the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-07-31 | — | — | US | disclosed |
| US-20100124719-A1 | Polymer and Resist Composition Comprising the Same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-05-20 | — | — | US | disclosed |