⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12164678 | 1.00 | — | — | |
| SCHEMBL14535578 | 0.74 | — | — | |
| SCHEMBL13899690 | 0.71 | — | — | |
| SCHEMBL11993838 | 0.71 | — | — | |
| SCHEMBL8313622 | 0.71 | — | — | |
| SCHEMBL9664556 | 0.71 | — | — | |
| SCHEMBL8320331 | 0.71 | — | — | |
| SCHEMBL5321769 | 0.71 | — | — | |
| SCHEMBL8315049 | 0.71 | — | — | |
| SCHEMBL10225746 | 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 |
|---|---|---|---|---|---|---|---|
| US-20080085886-A1 | Anticancer and/or antiinflammatory activity, MEK (MAP kinase kinase) inhibitors; for example, 3-(2-Fluoro-4-iodo-phenylamino)-furo[3,2-c]pyridine-2-carboxylic acid ((R)-2,3-dihydroxy-propoxy)-amide | GENENTECH, INC. | 2008-04-10 | — | — | US | disclosed |