⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7771084 | 1.00 | — | — | |
| SCHEMBL13900868 | 0.81 | — | — | |
| SCHEMBL28951691 | 0.74 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL12854848 | 0.72 | — | — | |
| SCHEMBL12020128 | 0.72 | — | — | |
| SCHEMBL25726773 | 0.72 | — | — | |
| SCHEMBL13662881 | 0.72 | — | — | |
| SCHEMBL27403399 | 0.72 | — | — | |
| SCHEMBL1751500 | 0.71 | — | — | |
| SCHEMBL28883788 | 0.70 | CA1 (0.42) | — |
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-20210017170-A1 | PROCESSES FOR PREPARING TOLL-LIKE RECEPTOR MODULATOR COMPOUNDS | GILEAD SCIENCES, INC. | 2021-01-21 | — | — | US | disclosed |