⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL108892 | 0.96 | — | — | |
| SCHEMBL5729396 | 0.92 | — | — | |
| SCHEMBL384218 | 0.92 | — | — | |
| SCHEMBL509640 | 0.92 | — | — | |
| Lithium Ion SCHEMBL384217 | 0.88 | — | — | |
| SCHEMBL15016076 | 0.88 | — | — | |
| SCHEMBL509639 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL8853911 | 0.88 | — | — | |
| SCHEMBL11270758 | 0.85 | — | — | |
| SCHEMBL8736018 | 0.82 | — | — |
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-2111372-B1 | Process for making suspensions of surface treated titanium (IV) oxides | DU PONT (US) | 2013-07-03 | — | — | EP | claimed |