⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19644575 | 0.86 | HIF1A (0.32) | — | |
| SCHEMBL21880622 | 0.83 | HIF1A (0.30) | — | |
| SCHEMBL24591621 | 0.81 | HIF1A (0.31) | — | |
| SCHEMBL21880508 | 0.81 | HIF1A (0.31) | — | |
| SCHEMBL24591624 | 0.81 | HIF1A (0.31) | — | |
| SCHEMBL21136376 | 0.77 | HIF1A (0.32) | — | |
| SCHEMBL19644599 | 0.76 | HIF1A (0.35) | — | |
| SCHEMBL19644592 | 0.72 | HIF1A (0.30) | — | |
| SCHEMBL19644580 | 0.72 | HIF1A (0.30) | — | |
| SCHEMBL21137110 | 0.71 | HIF1A (0.33) | — |
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-9828388-B2 | Thieno[3,2-d]pyrimidine, furo[3,2-d]pyrimidine, and pyrrolo[3,2-D]pyrimidines useful for treating respiratory syncitial virus infections | GILEAD SCIENCES, INC. (US) | 2017-11-28 | — | — | US | disclosed |