⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8154140 | 0.73 | FDPS (0.30) | — | |
| SCHEMBL17888812 | 0.67 | THRB (0.35) | — | |
| SCHEMBL28534554 | 0.65 | SPHK2 (0.33) | — | |
| SCHEMBL19424014 | 0.65 | ALDH1A1 (0.36) | — | |
| SCHEMBL8607 | 0.65 | FDPS (0.33) | — | |
| SCHEMBL1446077 | 0.65 | THRB (0.35) | — | |
| SCHEMBL17888811 | 0.64 | TDP1 (0.35) | — | |
| SCHEMBL7924518 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL4892680 | 0.64 | SPHK1 (0.41) | — | |
| Bromide SCHEMBL14778203 | 0.63 | FDPS (0.32) | — |
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-8062821-B2 | Toner, and process cartridge and image forming apparatus using the same | RICOH COMPANY, LIMITED (JP) | 2011-11-22 | — | — | US | claimed |