⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2812430 | 0.77 | — | — | |
| SCHEMBL2813314 | 0.77 | — | — | |
| SCHEMBL2812484 | 0.72 | — | — | |
| SCHEMBL2813465 | 0.70 | — | — | |
| SCHEMBL2810027 | 0.70 | — | — | |
| SCHEMBL2813249 | 0.69 | — | — | |
| SCHEMBL2814749 | 0.69 | — | — | |
| Dichlorodifluoromethane SCHEMBL28682201 | 0.69 | — | — | |
| SCHEMBL11724645 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL65851 | 0.65 | — | — |
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-20100249302-A1 | LIQUID COMPOSITION CONTAINING PERFLUORO-CHLOROETHER SOLVENT | FUJIFILM CORPORATION (JP) | 2010-09-30 | — | — | US | disclosed |