⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9498852 | 0.83 | KDM4E (0.39) | — | |
| SCHEMBL1857169 | 0.80 | — | — | |
| SCHEMBL11298932 | 0.79 | TYMP (0.39) | — | |
| SCHEMBL28969640 | 0.77 | — | — | |
| SCHEMBL13695320 | 0.77 | PPARD (0.33) | — | |
| SCHEMBL14675830 | 0.77 | TYMP (0.38) | — | |
| SCHEMBL2355129 | 0.76 | KDM4E (0.44) | — | |
| SCHEMBL8711371 | 0.74 | — | — | |
| Dimethoxymethane SCHEMBL27793196 | 0.74 | CA2 (0.38) | — | |
| SCHEMBL1573316 | 0.72 | — | — |
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-0398231-B1 | Nucleoside analogs | ACAD OF SCIENCE CZECH REPUBLIC (CZ) | 1997-07-16 | — | — | EP | claimed |