⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15500507 | 0.86 | — | — | |
| SCHEMBL789662 | 0.84 | — | — | |
| SCHEMBL1831137 | 0.84 | — | — | |
| SCHEMBL900224 | 0.81 | TSHR (0.33) | — | |
| SCHEMBL3938413 | 0.73 | — | — | |
| SCHEMBL6538240 | 0.73 | — | — | |
| SCHEMBL15424371 | 0.66 | — | — | |
| SCHEMBL10859718 | 0.66 | — | — | |
| SCHEMBL24500683 | 0.65 | — | — | |
| SCHEMBL6539087 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5530162-A | Process for the hydrogenation of aryl phosphines and products obtained therefrom | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1996-06-25 | — | — | US | disclosed |