⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL337285 | 0.97 | — | — | |
| SCHEMBL7081314 | 0.94 | — | — | |
| SCHEMBL503897 | 0.94 | — | — | |
| Methylamine SCHEMBL9791403 | 0.92 | ADRB2 (0.43) | — | |
| Methylene Chloride SCHEMBL27495230 | 0.90 | TSHR (0.37) | — | |
| SCHEMBL169709 | 0.89 | — | — | |
| SCHEMBL4879666 | 0.87 | TSHR (0.36) | — | |
| SCHEMBL486846 | 0.86 | THRB (0.44) | — | |
| SCHEMBL22261008 | 0.86 | THRB (0.44) | — | |
| SCHEMBL3716811 | 0.86 | THRB (0.44) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5434143-A | ANTILIPEMIC AGENTS, ANTITUMOR AGENTS AND ANTIINFLAMMATORY AGENTS | BORON BIOLOGICALS, INC. (US) | 1995-07-18 | — | — | US | disclosed |
| EP-0651758-A4 | PHOSPHITE-BORANE COMPOUNDS, AND METHOD OF MAKING THE SAME. | — | 1995-06-14 | — | — | EP | disclosed |
| EP-0651758-A1 | PHOSPHITE-BORANE COMPOUNDS, AND METHOD OF MAKING THE SAME | BORON BIOLOGICALS, INC. (US) | 1995-05-10 | — | — | EP | disclosed |
| WO-1994001444-A1 | PHOSPHITE-BORANE COMPOUNDS, AND METHOD OF MAKING THE SAME | BORON BIOLOGICALS, INC. (US) | 1994-01-20 | — | — | WO | disclosed |
| US-5260427-A | Nucleosidylphosphite-borane compounds and method of making the same | BORON BIOLGICALS, INC. (US) | 1993-11-09 | — | — | US | disclosed |