⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10206859 | 0.87 | TSHR (0.37) | — | |
| SCHEMBL9974627 | 0.86 | — | — | |
| SCHEMBL14765506 | 0.82 | KMT2A (0.33) | — | |
| SCHEMBL14548632 | 0.80 | TSHR (0.41) | — | |
| SCHEMBL9974625 | 0.78 | KMT2A (0.31) | — | |
| SCHEMBL16328161 | 0.77 | KMT2A (0.32) | — | |
| SCHEMBL14765508 | 0.76 | KMT2A (0.34) | — | |
| SCHEMBL14765503 | 0.76 | KMT2A (0.33) | — | |
| SCHEMBL13183217 | 0.76 | GABRP (0.35) | — | |
| SCHEMBL12845906 | 0.75 | GABRP (0.38) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8328344-B2 | Aqueous ink composition for inkjet recording and image forming method | FUJIFILM CORPORATION (JP) | 2012-12-11 | — | — | US | disclosed |
| US-20120165436-A1 | PIGMENT DISPERSION CONTAINING AZO PIGMENT AND AQUEOUS INK FOR INKJET RECORDING USING THE SAME | FUJIFILM CORPORATION (JP) | 2012-06-28 | — | — | US | disclosed |
| US-20120165437-A1 | AQUEOUS PIGMENT DISPERSION AND AQUEOUS INK FOR INKJET RECORDING | FUJIFILM CORPORATION (JP) | 2012-06-28 | — | — | US | disclosed |
| US-20100222472-A1 | WATER-BASED INK COMPOSITION FOR INKJET RECORDING | FUJIFILM CORPORATION (JP) | 2010-09-02 | — | — | US | disclosed |