⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13201155 | 1.00 | — | — | |
| SCHEMBL28750061 | 0.77 | CA1 (0.44) | — | |
| SCHEMBL10438993 | 0.77 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL28356387 | 0.77 | CYP1A2 (0.47) | — | |
| SCHEMBL8049560 | 0.77 | CYP1A2 (0.33) | — | |
| SCHEMBL7195001 | 0.76 | — | — | |
| SCHEMBL17484531 | 0.76 | — | — | |
| SCHEMBL31634542 | 0.76 | CYP1A2 (0.50) | — | |
| SCHEMBL6310548 | 0.76 | CYP1A2 (0.50) | — | |
| SCHEMBL27563697 | 0.73 | CA1 (0.41) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7785839-B2 | Methods to manufacture 1,3-dioxolane nucleosides | EMORY UNIVERSITY (US) | 2010-08-31 | — | — | US | disclosed |
| US-7560550-B2 | Method for the production of OH protected[4-(2.6-diamino-9H-purine-9-yl)-1.3-dioxolane-2-yl]methanol derivatives | RFS PHARMA, LLC (US) | 2009-07-14 | — | — | US | disclosed |