⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19997395 | 1.00 | — | — | |
| SCHEMBL19997384 | 0.91 | — | — | |
| SCHEMBL24168593 | 0.90 | DCPS (0.31) | — | |
| SCHEMBL20380392 | 0.87 | — | — | |
| SCHEMBL19997433 | 0.87 | TLR7 (0.31) | — | |
| SCHEMBL23278043 | 0.87 | TLR7 (0.31) | — | |
| SCHEMBL19997439 | 0.84 | TNK2 (0.36) | — | |
| SCHEMBL12243146 | 0.82 | HSPA5 (0.34) | — | |
| SCHEMBL12393303 | 0.78 | — | — | |
| SCHEMBL20380389 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-RE46762-E1 | 1′-substituted carba-nucleoside analogs for antiviral treatment | GILEAD SCIENCES, INC (US) | 2018-03-27 | — | — | US | disclosed |