⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22895058 | 0.88 | — | — | |
| SCHEMBL23511217 | 0.87 | — | — | |
| SCHEMBL20990888 | 0.87 | — | — | |
| SCHEMBL21577205 | 0.86 | — | — | |
| SCHEMBL23511178 | 0.86 | — | — | |
| SCHEMBL22801868 | 0.85 | — | — | |
| SCHEMBL20990721 | 0.85 | — | — | |
| SCHEMBL20990835 | 0.85 | — | — | |
| SCHEMBL21577180 | 0.85 | ALOX15 (0.33) | — | |
| SCHEMBL22895047 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10894763-B2 | Methods and compositions for terpenoid tricycloalkane synthesis | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) | 2021-01-19 | — | — | US | disclosed |
| US-20190352254-A1 | METHODS AND COMPOSITIONS FOR TERPENOID TRICYCLOALKANE SYNTHESIS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. | 2019-11-21 | — | — | US | disclosed |