⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17733565 | 0.84 | — | — | |
| SCHEMBL13194525 | 0.84 | — | — | |
| SCHEMBL17733571 | 0.82 | AURKA (0.32) | — | |
| SCHEMBL12568846 | 0.78 | — | — | |
| SCHEMBL16359270 | 0.77 | TSHR (0.36) | — | |
| SCHEMBL20367047 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL19336505 | 0.76 | CCR2 (0.31) | — | |
| SCHEMBL20117169 | 0.72 | — | — | |
| SCHEMBL13493015 | 0.72 | — | — | |
| SCHEMBL24593370 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1964845-A1 | New thiophen glycoside derivatives, method for their manufacture, medicines containing these compounds and their application | Sanofi-Aventis Deutschland GmbH (DE) | 2008-09-03 | — | — | EP | disclosed |
| WO-2008061781-A1 | THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES | NV REMYND (BE) | 2008-05-29 | — | — | WO | disclosed |