⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL277289 | 0.83 | LMNA (0.33) | — | |
| SCHEMBL27089787 | 0.77 | TDP1 (0.30) | — | |
| SCHEMBL23967673 | 0.76 | — | — | |
| SCHEMBL5932128 | 0.71 | TAS1R3 (0.34) | — | |
| SCHEMBL18576568 | 0.70 | SLC6A4 (0.38) | — | |
| SCHEMBL24070903 | 0.70 | SLC6A4 (0.32) | — | |
| SCHEMBL24070907 | 0.70 | SLC6A4 (0.32) | — | |
| SCHEMBL23380186 | 0.70 | LMNA (0.41) | — | |
| SCHEMBL22642529 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL13747070 | 0.69 | CA1 (0.31) | — |
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-20180133244-A1 | METHODS AND COMPOSITIONS FOR SELECTIVELY REMOVING POTASSIUM ION FROM THE GASTROINTESTINAL TRACT OF A MAMMAL | VIFOR (INTERNATIONAL) LTD. (CH) | 2018-05-17 | — | — | US | disclosed |