⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27084397 | 0.82 | — | — | |
| SCHEMBL9338929 | 0.71 | — | — | |
| SCHEMBL27475540 | 0.70 | — | — | |
| SCHEMBL1933931 | 0.70 | — | — | |
| SCHEMBL10385419 | 0.67 | — | — | |
| SCHEMBL8346844 | 0.66 | — | — | |
| SCHEMBL5254735 | 0.66 | — | — | |
| SCHEMBL45283 | 0.65 | — | — | |
| SCHEMBL5255955 | 0.65 | — | — | |
| SCHEMBL2536891 | 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 |
|---|---|---|---|---|---|---|---|
| CN-1113574-A | Toner for developing electrostatic image, image forming method and process cartridge | CANON KK (JP) | 1995-12-20 | — | — | CN | disclosed |