⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31384137 | 0.83 | — | — | |
| SCHEMBL28728387 | 0.79 | — | — | |
| SCHEMBL7868032 | 0.75 | — | — | |
| SCHEMBL27890647 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL12152755 | 0.75 | — | — | |
| SCHEMBL22055 | 0.75 | — | — | |
| SCHEMBL27530373 | 0.74 | — | — | |
| SCHEMBL9074462 | 0.74 | — | — | |
| SCHEMBL11044730 | 0.73 | — | — | |
| SCHEMBL10840467 | 0.73 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150241805-A1 | Co-emulsification of Insoluble Compounds with Toner Resins | U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT | 2015-08-27 | — | — | US | claimed |
| CN-113195640-B | Aqueous inkjet yellow ink, ink set, and method for producing printed matter | 爱天思株式会社 | 2024-03-22 | — | — | CN | disclosed |