⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13610 | 0.97 | — | — | |
| SCHEMBL900195 | 0.94 | — | — | |
| SCHEMBL29952 | 0.94 | — | — | |
| SCHEMBL1604554 | 0.94 | — | — | |
| SCHEMBL2868065 | 0.94 | — | — | |
| SCHEMBL5231994 | 0.94 | — | — | |
| Formaldehyde SCHEMBL5303037 | 0.94 | — | — | |
| SCHEMBL2547723 | 0.94 | — | — | |
| SCHEMBL6703749 | 0.94 | — | — | |
| SCHEMBL461367 | 0.94 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103339122-B | photochromic compounds and compositions | 光学转变公司 | 2017-03-22 | — | — | CN | disclosed |
| US-5039576-A | From bath having alkyl sulfonic acid electrolyte, low melting | ATOCHEM NORTH AMERICA, INC. (US) | 1991-08-13 | — | — | US | disclosed |