⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1480772 | 1.00 | — | — | |
| SCHEMBL28328581 | 1.00 | — | — | |
| SCHEMBL28033482 | 1.00 | — | — | |
| SCHEMBL28034044 | 1.00 | — | — | |
| SCHEMBL8006954 | 0.82 | — | — | |
| SCHEMBL8596955 | 0.82 | — | — | |
| SCHEMBL7886174 | 0.82 | — | — | |
| SCHEMBL14764480 | 0.82 | — | — | |
| SCHEMBL10818653 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL29203941 | 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 |
|---|---|---|---|---|---|---|---|
| CN-110395734-B | Method for producing granular metal and titanium carbide by using red mud as raw material | 北京科技大学 | 2020-10-13 | — | — | CN | disclosed |