⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6395180 | 0.83 | — | — | |
| SCHEMBL13591198 | 0.81 | — | — | |
| SCHEMBL4692524 | 0.79 | CA1 (0.39) | — | |
| SCHEMBL6791844 | 0.79 | — | — | |
| SCHEMBL10781106 | 0.77 | ALOX15 (0.36) | — | |
| SCHEMBL28122874 | 0.76 | ALOX15 (0.34) | — | |
| SCHEMBL27866143 | 0.76 | ALOX15 (0.34) | — | |
| SCHEMBL4393163 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL27325645 | 0.76 | ALOX15 (0.34) | — | |
| SCHEMBL2078307 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105106199-A | Methods of using MEK inhibitors | EXELIXIS INC | 2015-12-02 | — | — | CN | disclosed |