⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12285378 | 0.86 | — | — | |
| SCHEMBL14640864 | 0.82 | — | — | |
| SCHEMBL23552118 | 0.78 | LMNA (0.40) | — | |
| SCHEMBL12233208 | 0.76 | — | — | |
| SCHEMBL19807670 | 0.76 | — | — | |
| SCHEMBL1050267 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL14034298 | 0.73 | — | — | |
| SCHEMBL14349363 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL12360954 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL28030709 | 0.72 | MEN1 (0.44) | — |
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-7166611-B2 | Plant extract comprising steroidal glycosides from the genus Trichocaulon or Hoodia produced by solvent extraction | CSIR (ZA) | 2007-01-23 | — | — | US | disclosed |