⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2820013 | 1.00 | — | — | |
| SCHEMBL1215840 | 0.89 | — | — | |
| SCHEMBL11430367 | 0.89 | — | — | |
| SCHEMBL9408868 | 0.89 | — | — | |
| SCHEMBL11150829 | 0.89 | — | — | |
| SCHEMBL8985632 | 0.80 | — | — | |
| SCHEMBL31300062 | 0.80 | — | — | |
| SCHEMBL11670384 | 0.80 | — | — | |
| SCHEMBL11868724 | 0.80 | — | — | |
| SCHEMBL28699532 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2109692-A1 | AUSTENITIC STAINLESS STEEL | ThyssenKrupp Acciai Speciali Terni S.p.A. (IT) | 2009-10-21 | — | — | EP | disclosed |
| WO-2008099336-A1 | AUSTENITIC STAINLESS STEEL | THYSSENKRUPP ACCIALI SPECIALI TERNI S.P.A. (IT) | 2008-08-21 | — | — | WO | disclosed |