⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3135774 | 0.91 | — | — | |
| SCHEMBL9445010 | 0.89 | — | — | |
| SCHEMBL1073724 | 0.80 | — | — | |
| SCHEMBL2291226 | 0.79 | — | — | |
| SCHEMBL13970968 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL23863512 | 0.74 | — | — | |
| SCHEMBL6896259 | 0.74 | — | — | |
| SCHEMBL10883662 | 0.74 | — | — | |
| SCHEMBL9724683 | 0.74 | KDM4E (0.31) | — | |
| SCHEMBL23863447 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991014198-A1 | ELECTROCHROMIC DEVICE | THE DOW CHEMICAL COMPANY (US) | 1991-09-19 | — | — | WO | disclosed |