⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14724513 | 0.83 | — | — | |
| SCHEMBL14714542 | 0.71 | — | — | |
| SCHEMBL14714746 | 0.68 | — | — | |
| SCHEMBL14714659 | 0.68 | TPMT (0.39) | — | |
| SCHEMBL14724483 | 0.68 | TPMT (0.33) | — | |
| SCHEMBL14724507 | 0.66 | TPMT (0.34) | — | |
| SCHEMBL643967 | 0.64 | ALDH1A1 (0.59) | — | |
| SCHEMBL14715076 | 0.62 | — | — | |
| SCHEMBL14724570 | 0.62 | TPMT (0.36) | — | |
| SCHEMBL14724436 | 0.61 | TPMT (0.35) | — |
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-2562155-A1 | NOVEL HYDROXAMIC ACID DERIVATIVE | Taisho Pharmaceutical Co., Ltd. (JP) | 2013-02-27 | — | — | EP | disclosed |