⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10717070 | 0.81 | — | — | |
| SCHEMBL4910438 | 0.78 | — | — | |
| SCHEMBL2469279 | 0.77 | TSHR (0.30) | — | |
| SCHEMBL895709 | 0.74 | THRB (0.30) | — | |
| SCHEMBL3160002 | 0.69 | — | — | |
| SCHEMBL896450 | 0.68 | — | — | |
| SCHEMBL162164 | 0.68 | — | — | |
| SCHEMBL29175055 | 0.67 | — | — | |
| SCHEMBL2170883 | 0.67 | — | — | |
| SCHEMBL3163324 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109554018-A | Inkjet compositions group and ink jet recording method | 精工爱普生株式会社 | 2019-04-02 | — | — | CN | disclosed |
| CN-108504181-A | Radiation-curing type inkjet compositions and recording method | 精工爱普生株式会社 | 2018-09-07 | — | — | CN | disclosed |