⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1993122 | 0.85 | — | — | |
| SCHEMBL166828 | 0.78 | — | — | |
| SCHEMBL340763 | 0.78 | — | — | |
| SCHEMBL2806378 | 0.78 | — | — | |
| Trichloromonofluoromethane SCHEMBL27433994 | 0.75 | ALDH1A1 (0.44) | — | |
| SCHEMBL10526595 | 0.75 | — | — | |
| SCHEMBL23356471 | 0.73 | — | — | |
| Dichlorodifluoromethane SCHEMBL7261256 | 0.73 | — | — | |
| SCHEMBL6983119 | 0.73 | — | — | |
| SCHEMBL254501 | 0.73 | — | — |
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-20070077660-A1 | Method for the detection of a cannabinoid, detection kit, and developing solvent | GLAS RONALD J | 2007-04-05 | — | — | US | disclosed |