⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15897537 | 0.89 | — | — | |
| SCHEMBL15880226 | 0.87 | — | — | |
| SCHEMBL15880230 | 0.87 | — | — | |
| SCHEMBL15897547 | 0.86 | NPC1 (0.54) | — | |
| SCHEMBL15880193 | 0.86 | — | — | |
| SCHEMBL15897557 | 0.86 | NPC1 (0.64) | — | |
| SCHEMBL15897561 | 0.86 | — | — | |
| SCHEMBL15897542 | 0.86 | — | — | |
| SCHEMBL15880195 | 0.86 | — | — | |
| SCHEMBL15897545 | 0.84 | — | — |
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-10730848-B2 | Protective molecules against anthrax toxin | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-08-04 | — | — | US | disclosed |
| EP-3303285-B1 | PESTICIDALLY ACTIVE OXIME AND HYDRAZONE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2020-02-19 | — | — | EP | disclosed |