⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5868446 | 0.86 | AKR1B10 (0.33) | — | |
| SCHEMBL18595246 | 0.85 | SHBG (0.36) | — | |
| SCHEMBL760606 | 0.85 | SHBG (0.36) | — | |
| SCHEMBL10410693 | 0.83 | CYP2C19 (0.37) | — | |
| SCHEMBL483052 | 0.79 | — | — | |
| SCHEMBL13168808 | 0.79 | HSD17B3 (0.40) | — | |
| SCHEMBL27314732 | 0.76 | — | — | |
| SCHEMBL21961611 | 0.76 | — | — | |
| SCHEMBL7934764 | 0.73 | SHBG (0.30) | — | |
| SCHEMBL21961609 | 0.73 | SHBG (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1567678-B1 | PROCESS FOR TANNING AND TANNING AGENT | TFL LEDERTECHNIK GMBH (DE) | 2012-03-21 | — | — | EP | disclosed |
| EP-1567678-A1 | PROCESS FOR TANNING AND TANNING AGENT | TFL Ledertechnik GmbH (DE) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004053170-A1 | PROCESS FOR TANNING AND TANNING AGENT | TFL LEDERTECHNIK GMBH (DE) | 2004-06-24 | — | — | WO | disclosed |