⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19787011 | 0.91 | TSHR (0.32) | — | |
| SCHEMBL204034 | 0.89 | TSHR (0.32) | — | |
| Ammonia Solution, Strong SCHEMBL21828798 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL29674430 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL20211370 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL20782422 | 0.82 | — | — | |
| SCHEMBL24487862 | 0.81 | — | — | |
| SCHEMBL30389839 | 0.80 | TSHR (0.34) | — | |
| SCHEMBL12134556 | 0.80 | — | — | |
| SCHEMBL10169834 | 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-20210139522-A1 | ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND USES THEREOF | Lakewood Amedex, Inc. | 2021-05-13 | — | — | US | disclosed |
| WO-2020247818-A1 | UNA AMIDITES AND USES THEREOF | AVIDITY BIOSCIENCES, INC. (US) | 2020-12-10 | — | — | WO | disclosed |