⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7074325 | 0.84 | MMP2 (0.31) | — | |
| SCHEMBL29852867 | 0.77 | CA12 (0.33) | — | |
| SCHEMBL4269654 | 0.76 | KDM4E (0.30) | — | |
| SCHEMBL19347953 | 0.73 | LAP3 (0.37) | — | |
| SCHEMBL28364307 | 0.73 | LAP3 (0.37) | — | |
| SCHEMBL23264148 | 0.72 | — | — | |
| SCHEMBL3725774 | 0.69 | LAP3 (0.44) | — | |
| SCHEMBL3722209 | 0.69 | LAP3 (0.44) | — | |
| SCHEMBL4265150 | 0.67 | MMP2 (0.36) | — | |
| SCHEMBL4268951 | 0.67 | MMP2 (0.36) | — |
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-1150988-B1 | PHOSPHORAMIDATE, AND MONO-, DI-, AND TRI-PHOSPHATE ESTERS OF (1R, CIS)-4-(6-AMINO-9H-PURIN-9-YL)-2-CYCLOPENTENE-1-METHANOL AS ANTIVIRAL AGENTS | GLAXO GROUP LTD (GB) | 2003-05-28 | — | — | EP | claimed |