⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4258206 | 0.69 | — | — | |
| SCHEMBL12675478 | 0.59 | — | — | |
| SCHEMBL196117 | 0.58 | ALDH1A1 (0.36) | — | |
| SCHEMBL12319889 | 0.57 | — | — | |
| SCHEMBL4261562 | 0.57 | — | — | |
| SCHEMBL2078957 | 0.56 | ALDH1A1 (0.33) | — | |
| Fluoride SCHEMBL15367056 | 0.56 | ALDH1A1 (0.33) | — | |
| SCHEMBL9387756 | 0.56 | ALDH1A1 (0.33) | — | |
| SCHEMBL14816959 | 0.56 | ALDH1A1 (0.33) | — | |
| SCHEMBL5732640 | 0.56 | ALDH1A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230151159-A1 | COMPOUND FOR FORMING HARDMASK, HARDMASK COMPOSITION INCLUDING THE COMPOUND, AND METHOD OF MANUFACTURING INTEGRATED CIRCUIT DEVICE USING THE HARDMASK COMPOSITION | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2023-05-18 | — | — | US | disclosed |