⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12294419 | 0.92 | ADORA2A (0.35) | — | |
| SCHEMBL12836487 | 0.88 | — | — | |
| SCHEMBL12295270 | 0.86 | — | — | |
| SCHEMBL12243133 | 0.85 | — | — | |
| SCHEMBL20380379 | 0.85 | — | — | |
| SCHEMBL20380380 | 0.84 | HSPA5 (0.37) | — | |
| SCHEMBL12243250 | 0.83 | PIK3CD (0.33) | — | |
| SCHEMBL15084422 | 0.82 | HSPA5 (0.32) | — | |
| SCHEMBL10149670 | 0.79 | — | — | |
| SCHEMBL17615386 | 0.79 | — | — |
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-10023600-B2 | Processes and intermediates for the preparation of 1′-substituted carba-nucleoside analogs | GILEAD SCIENCES, INC. (US) | 2018-07-17 | — | — | US | disclosed |
| US-20110230654-A1 | PROCESSES AND INTERMEDIATES FOR THE PREPARATION OF 1'-SUBSTITUTED CARBA-NUCLEOSIDE ANALOGS | GILEAD SCIENCES, INC. (US) | 2011-09-22 | — | — | US | disclosed |