⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4925405 | 0.84 | ALOX15 (0.36) | — | |
| SCHEMBL8639456 | 0.81 | — | — | |
| SCHEMBL678671 | 0.79 | CYP2D6 (0.39) | — | |
| SCHEMBL8640945 | 0.78 | — | — | |
| SCHEMBL10396148 | 0.78 | TET2 (0.32) | — | |
| Fluoride SCHEMBL3612510 | 0.78 | CYP2D6 (0.38) | — | |
| SCHEMBL2368022 | 0.76 | — | — | |
| SCHEMBL8639459 | 0.76 | — | — | |
| SCHEMBL29152228 | 0.76 | — | — | |
| SCHEMBL7762769 | 0.76 | — | — |
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-20080076054-A1 | Toner, production method thereof, toner container, developer, image forming apparatus and process cartridge using the same | RICOH COMPANY, LTD. (JP) | 2008-03-27 | — | — | US | disclosed |