⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL312784 | 0.61 | — | — | |
| SCHEMBL8018531 | 0.56 | — | — | |
| SCHEMBL8835287 | 0.56 | — | — | |
| SCHEMBL545863 | 0.52 | — | — | |
| SCHEMBL14762339 | 0.50 | — | — | |
| SCHEMBL17973983 | 0.50 | — | — | |
| SCHEMBL16479528 | 0.49 | — | — | |
| SCHEMBL22165969 | 0.46 | — | — | |
| SCHEMBL1382945 | 0.43 | — | — | |
| SCHEMBL735951 | 0.39 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0970964-A2 | Method for producing titanium complex | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |