⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4093276 | 1.00 | — | — | |
| SCHEMBL31352918 | 1.00 | — | — | |
| SCHEMBL29793519 | 1.00 | — | — | |
| SCHEMBL157229 | 1.00 | — | — | |
| SCHEMBL16553398 | 1.00 | — | — | |
| SCHEMBL29886140 | 1.00 | — | — | |
| Fluoride SCHEMBL11154391 | 0.71 | — | — | |
| SCHEMBL10685135 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7075086 | 0.71 | — | — | |
| SCHEMBL8641934 | 0.71 | — | — |
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-106676325-B | A kind of as cast condition fine grain high strength titanium zirconium aluminium niobium alloy and preparation method thereof | 燕山大学 | 2018-06-08 | — | — | CN | disclosed |
| CN-106676325-A | As-cast fine-grain high-strength titanium-zirconium-aluminum-niobium alloy and preparation method thereof | 燕山大学 | 2017-05-17 | — | — | CN | disclosed |