⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7843219 | 0.81 | TSHR (0.44) | — | |
| SCHEMBL16378586 | 0.81 | TSHR (0.44) | — | |
| SCHEMBL2386598 | 0.80 | — | — | |
| SCHEMBL13310237 | 0.78 | — | — | |
| SCHEMBL17683837 | 0.78 | — | — | |
| SCHEMBL10432324 | 0.76 | ALDH1A1 (0.34) | — | |
| SCHEMBL6658330 | 0.76 | — | — | |
| SCHEMBL6658335 | 0.76 | — | — | |
| SCHEMBL14895229 | 0.76 | — | — | |
| SCHEMBL3698965 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019135010-A1 | TIACUMICIN DERIVATIVES AND THEIR USE AS ANTIBIOTICS | Universität Zürich (CH) | 2019-07-11 | — | — | WO | disclosed |