⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30063344 | 0.79 | — | — | |
| SCHEMBL681118 | 0.78 | — | — | |
| SCHEMBL16092680 | 0.76 | HMGCR (0.50) | — | |
| SCHEMBL4282052 | 0.76 | — | — | |
| SCHEMBL12464050 | 0.75 | MCL1 (0.41) | — | |
| SCHEMBL13247988 | 0.75 | LMNA (0.44) | — | |
| SCHEMBL6205081 | 0.75 | MCL1 (0.34) | — | |
| SCHEMBL19010446 | 0.75 | KDM4E (0.54) | — | |
| SCHEMBL9925425 | 0.75 | MCL1 (0.42) | — | |
| SCHEMBL24920461 | 0.74 | MCL1 (0.37) | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3357918-A1 | NOVEL PYRIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2018-08-08 | — | — | EP | claimed |
| EP-2928881-B1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2018-03-14 | — | — | EP | claimed |
| US-9522886-B2 | Pyridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2016-12-20 | — | — | US | claimed |
| US-20150307452-A1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2015-10-29 | — | — | US | claimed |
| EP-2928881-A1 | NOVEL PYRIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2015-10-14 | — | — | EP | claimed |
| WO-2014086705-A1 | NOVEL PYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2014-06-12 | — | — | WO | claimed |
| CN-112480121-A | Polycyclic derivative and preparation thereof | 四川海思科制药有限公司 | 2021-03-12 | — | — | CN | disclosed |
| WO-2019013789-A1 | ANTIMICROBIAL COMPOUNDS | CURZA GLOBAL, LLC (US) | 2019-01-17 | — | — | WO | disclosed |
| EP-3357918-A1 | NOVEL PYRIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2018-08-08 | — | — | EP | disclosed |
| EP-2928881-B1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2018-03-14 | — | — | EP | disclosed |
| US-9522886-B2 | Pyridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2016-12-20 | — | — | US | disclosed |
| US-20150307452-A1 | NOVEL PYRIDINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2015-10-29 | — | — | US | disclosed |
| EP-2928881-A1 | NOVEL PYRIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2015-10-14 | — | — | EP | disclosed |
| WO-2014086705-A1 | NOVEL PYRIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2014-06-12 | — | — | WO | disclosed |
| EP-0796646-B1 | Method for the removal of carbon dioxide present in gases and absorbent | KANSAI ELECTRIC POWER CO (JP) | 2003-11-12 | — | — | EP | disclosed |
| US-6051161-A | BRINGING A CARBON DIOXIDE CONTAINING GAS INTO CONTACT WITH AN AQUEOUS SOLUTION CONTAINING AT LEAST ONE AMINE COMPOUND; REDUCTION IN THERMAL ENERGY REQUIRED FOR REGENERATION OF THE AQUEOUS SOLUTION | THE KANSAI ELECTRIC POWER CO., INC. (JP) | 2000-04-18 | — | — | US | disclosed |
| EP-0796646-A1 | Method for the removal of carbon dioxide present in gases and absorbent | THE KANSAI ELECTRIC POWER CO., INC. (JP) | 1997-09-24 | — | — | EP | disclosed |
| US-5468746-A | A dicarboxy-4-aryldihydropyridine | ZAMBON GROUP S.P.A. (IT) | 1995-11-21 | — | — | US | disclosed |
| EP-0352863-A2 | 1,4-Dihydropyridine dicarboxylic acid derivatives | ZAMBON GROUP S.p.A. (IT) | 1990-01-31 | — | — | EP | disclosed |