⚠ 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 | |
|---|---|---|---|---|
| Cyclopropane SCHEMBL8954008 | 1.00 | — | — | |
| SCHEMBL17144160 | 0.95 | — | — | |
| Hydrogen Sulfide SCHEMBL7638603 | 0.95 | — | — | |
| SCHEMBL15663 | 0.95 | — | — | |
| SCHEMBL23199234 | 0.92 | — | — | |
| Methane SCHEMBL4558430 | 0.92 | — | — | |
| SCHEMBL539983 | 0.92 | — | — | |
| SCHEMBL8744575 | 0.92 | — | — | |
| SCHEMBL8773572 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL429473 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1962141-A2 | Electrostatic image developing toner, method for producing same, electrostatic image developer, image forming method and image forming apparatus | Fuji Xerox Co., Ltd. (JP) | 2008-08-27 | — | — | EP | disclosed |