⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3320953 | 0.86 | — | — | |
| SCHEMBL29230833 | 0.86 | — | — | |
| SCHEMBL5092375 | 0.86 | — | — | |
| SCHEMBL1934100 | 0.86 | — | — | |
| SCHEMBL22208124 | 0.86 | — | — | |
| SCHEMBL16635567 | 0.86 | — | — | |
| SCHEMBL2853164 | 0.86 | — | — | |
| SCHEMBL20680100 | 0.86 | — | — | |
| SCHEMBL5065905 | 0.80 | ATM (0.31) | — | |
| SCHEMBL5065952 | 0.80 | ATM (0.31) | — |
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-0553068-B1 | Process for the dehydration of dihydroxypiperidinedicarboxylates | ROHM & HAAS (US) | 1997-07-16 | — | — | EP | disclosed |
| EP-0553068-B1 | Process for the dehydration of dihydroxypiperidinedicarboxylates | ROHM & HAAS (US) | 1997-07-16 | — | — | EP | disclosed |
| EP-0553068-A1 | Process for the dehydration of dihydroxypiperidinedicarboxylates | ROHM AND HAAS COMPANY (US) | 1993-07-28 | — | — | EP | disclosed |
| EP-0553068-A1 | Process for the dehydration of dihydroxypiperidinedicarboxylates | ROHM AND HAAS COMPANY (US) | 1993-07-28 | — | — | EP | disclosed |
| US-5206369-A | Using concentrated sulfuric acid without a solvent | MONSANTO COMPANY (US) | 1993-04-27 | — | — | US | disclosed |
| US-5206369-A | Using concentrated sulfuric acid without a solvent | MONSANTO COMPANY (US) | 1993-04-27 | — | — | US | disclosed |