⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL28040571 | 0.87 | — | — | |
| SCHEMBL284510 | 0.87 | — | — | |
| SCHEMBL28267805 | 0.87 | — | — | |
| Methane SCHEMBL28110308 | 0.87 | — | — | |
| SCHEMBL25223679 | 0.75 | — | — | |
| Methane SCHEMBL28989048 | 0.75 | — | — | |
| SCHEMBL31412846 | 0.75 | — | — | |
| SCHEMBL18394012 | 0.75 | — | — | |
| Methane SCHEMBL29182267 | 0.75 | — | — | |
| Methane SCHEMBL28824184 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106011575-A | Nb-Ti-Ta-C (niobium-titanium-tantalum-carbon) alloy bar and preparation method thereof | 西北有色金属研究院 | 2016-10-12 | — | — | CN | disclosed |
| CN-106011575-A | Nb-Ti-Ta-C (niobium-titanium-tantalum-carbon) alloy bar and preparation method thereof | 西北有色金属研究院 | 2016-10-12 | — | — | CN | disclosed |