⚠ 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 | |
|---|---|---|---|---|
| Methoxymethane SCHEMBL10627012 | 0.77 | CHRM2 (0.31) | — | |
| SCHEMBL11544896 | 0.77 | — | — | |
| SCHEMBL8855424 | 0.74 | — | — | |
| SCHEMBL17599041 | 0.74 | — | — | |
| SCHEMBL26690010 | 0.74 | — | — | |
| SCHEMBL16288985 | 0.74 | — | — | |
| SCHEMBL16288544 | 0.74 | — | — | |
| SCHEMBL7617200 | 0.74 | — | — | |
| SCHEMBL7037811 | 0.74 | — | — | |
| SCHEMBL1015770 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1539755-B1 | 6-ALKOXY-PYRIDO-PYRIMIDINES AS P-38 MAP KINASE INHIBITORS | HOFFMANN LA ROCHE (CH) | 2007-09-26 | — | — | EP | claimed |