⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL80934 | 0.81 | — | — | |
| SCHEMBL20199357 | 0.72 | — | — | |
| SCHEMBL16488112 | 0.69 | — | — | |
| SCHEMBL17063492 | 0.65 | — | — | |
| SCHEMBL15267902 | 0.63 | NFKB1 (0.33) | — | |
| SCHEMBL375585 | 0.62 | — | — | |
| SCHEMBL375567 | 0.61 | — | — | |
| SCHEMBL11738234 | 0.60 | — | — | |
| SCHEMBL933155 | 0.60 | — | — | |
| SCHEMBL15483863 | 0.57 | — | — |
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-20180149977-A1 | COMPOSITION FOR COATING RESIST PATTERN | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2018-05-31 | — | — | US | disclosed |