⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3684685 | 1.00 | — | — | |
| Ethambutol SCHEMBL9906602 | 0.89 | LMNA (1.00) | — | |
| Ethambutol SCHEMBL15479016 | 0.89 | LMNA (1.00) | — | |
| SCHEMBL12956362 | 0.89 | — | — | |
| Ethambutol SCHEMBL2961583 | 0.89 | LMNA (1.00) | — | |
| Ethambutol SCHEMBL2636850 | 0.89 | LMNA (1.00) | — | |
| Ethambutol SCHEMBL3399 | 0.89 | LMNA (1.00) | — | |
| Ethambutol SCHEMBL4029 | 0.89 | LMNA (1.00) | — | |
| Ethambutol SCHEMBL3026481 | 0.86 | ABCC3 (1.00) | — | |
| Ethambutol SCHEMBL37049 | 0.86 | ABCC3 (1.00) | — |
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-2019101853-A1 | TREATMENT OF SKIN DISORDERS | PIQUR THERAPEUTICS AG (CH) | 2019-05-31 | — | — | WO | disclosed |