⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16705461 | 0.79 | — | — | |
| SCHEMBL13715418 | 0.79 | — | — | |
| SCHEMBL790474 | 0.79 | — | — | |
| Dl-Dithiothreitol SCHEMBL28388554 | 0.77 | LMNA (0.39) | — | |
| Dithiothreitol SCHEMBL538995 | 0.76 | — | — | |
| Dl-Dithiothreitol SCHEMBL21114400 | 0.76 | LMNA (0.44) | — | |
| Dl-Dithiothreitol SCHEMBL14496668 | 0.76 | — | — | |
| Dl-Dithiothreitol SCHEMBL21114401 | 0.76 | LMNA (0.44) | — | |
| Dl-Dithiothreitol SCHEMBL17370231 | 0.76 | — | — | |
| Dl-Dithiothreitol SCHEMBL87345 | 0.76 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0629210-B1 | PEPTIDE LINKAGE UNIT COMPRISING METHYLENE PHOSPHINIC ACID | SCRIPPS RESEARCH INST (US) | 1998-06-10 | — | — | EP | disclosed |
| US-5563121-A | PHOSPHINATE METHYLENE AMMONIUM LINKAGE | THE SCRIPPS RESEARCH INSTITUTE (US) | 1996-10-08 | — | — | US | disclosed |
| EP-0629210-A1 | PEPTIDE LINKAGE UNIT COMPRISING METHYLENE PHOSPHINIC ACID | THE SCRIPPS RESEARCH INSTITUTE (US) | 1994-12-21 | — | — | EP | disclosed |
| WO-1993014114-A1 | PEPTIDE LINKAGE UNIT COMPRISING METHYLENE PHOSPHINIC ACID | THE SCRIPPS RESEARCH INSTITUTE (US) | 1993-07-22 | — | — | WO | disclosed |
| WO-1993009134-A1 | PHOSPHONAMIDATE ESTER-CONTAINING PSEUDOPEPTIDES | THE SCRIPPS RESEARCH INSTITUTE (US) | 1993-05-13 | — | — | WO | disclosed |
| US-3936422-A | Anti-static modified thermoplastics | CIBA-GEIGY CORPORATION (US) | 1976-02-03 | — | — | US | disclosed |