⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9958873 | 0.65 | — | — | |
| SCHEMBL20686770 | 0.61 | — | — | |
| SCHEMBL3810370 | 0.59 | — | — | |
| SCHEMBL22640645 | 0.58 | — | — | |
| SCHEMBL27883934 | 0.55 | — | — | |
| SCHEMBL3731943 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL6133279 | 0.54 | — | — | |
| Iodide SCHEMBL28286808 | 0.54 | — | — | |
| SCHEMBL20247441 | 0.53 | — | — | |
| SCHEMBL3615311 | 0.53 | PYGM (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2925757-B1 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | NOVARTIS AG (CH) | 2017-10-04 | — | — | EP | disclosed |