⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7856027 | 0.75 | — | — | |
| SCHEMBL19003123 | 0.75 | — | — | |
| SCHEMBL18139663 | 0.73 | TDP1 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL18140414 | 0.71 | TDP1 (0.32) | — | |
| SCHEMBL1010368 | 0.69 | — | — | |
| SCHEMBL965170 | 0.69 | — | — | |
| SCHEMBL6722150 | 0.67 | — | — | |
| SCHEMBL4161641 | 0.65 | — | — | |
| SCHEMBL28492986 | 0.65 | — | — | |
| SCHEMBL6172729 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5230297-A | — | — | None | — | — | JP | disclosed |
| JP-H05230297-A | NON-TARNISHING FLAME RETARDANT INSULATION COMPOSITION | QUANTUM CHEM CORP | 1993-09-07 | — | — | JP | disclosed |