⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3808233 | 0.87 | — | — | |
| SCHEMBL106433 | 0.87 | — | — | |
| SCHEMBL27518669 | 0.87 | TSHR (0.56) | — | |
| Methylamine SCHEMBL20854540 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL25173719 | 0.80 | — | — | |
| Iodide SCHEMBL3743824 | 0.80 | — | — | |
| SCHEMBL31444943 | 0.80 | — | — | |
| Hydrogen Sulfide SCHEMBL21878631 | 0.80 | — | — | |
| Lithium SCHEMBL30173601 | 0.80 | — | — | |
| Phosphine SCHEMBL28926219 | 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-2160153-A1 | STENTS | Nanovasc, Inc. (US) | 2010-03-10 | — | — | EP | disclosed |
| WO-2008154608-A1 | STENTS | NANOVASC, INC. (US) | 2008-12-18 | — | — | WO | disclosed |