⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7996604 | 0.75 | — | — | |
| SCHEMBL93809 | 0.74 | — | — | |
| SCHEMBL17472075 | 0.72 | — | — | |
| SCHEMBL16422023 | 0.72 | — | — | |
| SCHEMBL29324704 | 0.72 | — | — | |
| Bicarbonate SCHEMBL982714 | 0.70 | TSHR (0.50) | — | |
| SCHEMBL8204706 | 0.69 | — | — | |
| SCHEMBL17835289 | 0.69 | — | — | |
| SCHEMBL25156449 | 0.69 | — | — | |
| SCHEMBL15036562 | 0.68 | LMNA (0.32) | — |
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-20090247619-A1 | Cannabinoid-Containing Compositions and Methods for Their Use | UNIVERSITY OF KENTUCKY (US) | 2009-10-01 | — | — | US | disclosed |