⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13998189 | 0.85 | LMNA (0.31) | — | |
| SCHEMBL13906103 | 0.85 | LMNA (0.31) | — | |
| SCHEMBL14010918 | 0.78 | — | — | |
| B-D-Galactose SCHEMBL31152475 | 0.77 | STAT3 (0.40) | — | |
| SCHEMBL14010716 | 0.63 | — | — | |
| SCHEMBL31371996 | 0.60 | STAT3 (0.56) | — | |
| SCHEMBL1924154 | 0.54 | LMNA (0.35) | — | |
| SCHEMBL12438024 | 0.53 | LMNA (0.52) | — | |
| SCHEMBL5078178 | 0.51 | LMNA (0.44) | — | |
| SCHEMBL22246759 | 0.51 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080319042-A1 | Compositions and methods for treatment of liver disease | CALECO PHARMA CORP. | 2008-12-25 | — | — | US | disclosed |