⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL391827 | 0.78 | — | — | |
| SCHEMBL25532372 | 0.76 | DNM1 (0.41) | — | |
| SCHEMBL9393025 | 0.76 | — | — | |
| SCHEMBL8838853 | 0.76 | — | — | |
| SCHEMBL10596752 | 0.75 | CA12 (0.31) | — | |
| SCHEMBL25510145 | 0.74 | PRMT3 (0.62) | — | |
| SCHEMBL123822 | 0.73 | — | — | |
| Dimethylamine SCHEMBL8756712 | 0.72 | — | — | |
| SCHEMBL40090 | 0.71 | — | — | |
| SCHEMBL15623809 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2121649-B1 | Method for the production of benzofuran-2-carboxamides | MERCK PATENT GMBH (DE) | 2013-02-27 | — | — | EP | disclosed |