⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3179171 | 0.78 | — | — | |
| SCHEMBL14706244 | 0.78 | — | — | |
| SCHEMBL9873559 | 0.75 | THRB (0.73) | — | |
| SCHEMBL28143 | 0.73 | THRB (0.59) | — | |
| SCHEMBL5847043 | 0.69 | — | — | |
| SCHEMBL5333 | 0.69 | — | — | |
| SCHEMBL9114593 | 0.69 | THRB (0.53) | — | |
| SCHEMBL4694073 | 0.68 | THRB (0.46) | — | |
| SCHEMBL18928 | 0.67 | THRB (1.00) | — | |
| SCHEMBL14763948 | 0.67 | THRB (1.00) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1056710-B1 | DITERPENE DERIVATIVES AND ANTI-INFLAMMATORY ANALGESIC AGENTS COMPRISING THE SAME | SAE HAN PHARM CO LTD (KR) | 2003-12-10 | — | — | EP | claimed |
| US-6593363-B1 | The present invention relates to diterpene derivatives prepared from the components which are extracted from Acanthopanax Koreanum and represented by Chemical Formula (1). | SAE HAN PHARM. CO., LTD. (KR) | 2003-07-15 | — | — | US | claimed |
| EP-1056710-B1 | DITERPENE DERIVATIVES AND ANTI-INFLAMMATORY ANALGESIC AGENTS COMPRISING THE SAME | SAE HAN PHARM CO LTD (KR) | 2003-12-10 | — | — | EP | disclosed |
| US-6593363-B1 | The present invention relates to diterpene derivatives prepared from the components which are extracted from Acanthopanax Koreanum and represented by Chemical Formula (1). | SAE HAN PHARM. CO., LTD. (KR) | 2003-07-15 | — | — | US | disclosed |