⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4340455 | 0.62 | — | — | |
| SCHEMBL23895441 | 0.53 | — | — | |
| SCHEMBL1901955 | 0.48 | — | — | |
| SCHEMBL11028666 | 0.39 | — | — | |
| SCHEMBL21947377 | 0.39 | — | — | |
| SCHEMBL526351 | 0.37 | ALDH1A1 (0.50) | — | |
| SCHEMBL2359630 | 0.37 | TSHR (0.47) | — | |
| SCHEMBL64092 | 0.37 | GAA (1.00) | — | |
| SCHEMBL2204192 | 0.35 | ALDH1A1 (0.35) | — | |
| SCHEMBL522244 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7008476-B2 | Modified alginic acid of alginic acid derivatives and thermosetting anti-reflective compositions thereof | AZ ELECTRONIC MATERIALS USA CORP. (US) | 2006-03-07 | — | — | US | claimed |