⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22211129 | 0.86 | — | — | |
| SCHEMBL22251939 | 0.86 | — | — | |
| SCHEMBL4286711 | 0.82 | TNKS (0.37) | — | |
| SCHEMBL14945042 | 0.82 | CYP1A2 (0.30) | — | |
| SCHEMBL5534466 | 0.79 | — | — | |
| SCHEMBL28626243 | 0.77 | — | — | |
| SCHEMBL14244544 | 0.75 | — | — | |
| SCHEMBL22211135 | 0.73 | — | — | |
| SCHEMBL15113808 | 0.72 | FKBP1A (0.34) | — | |
| SCHEMBL18499830 | 0.72 | — | — |
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-7226721-B2 | Underlayer coating forming composition for lithography containing compound having protected carboxyl group | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2007-06-05 | — | — | US | disclosed |