⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12059836 | 0.73 | — | — | |
| SCHEMBL1924525 | 0.72 | LMNA (0.44) | — | |
| SCHEMBL9747332 | 0.69 | LMNA (0.41) | — | |
| SCHEMBL27603680 | 0.69 | LMNA (0.41) | — | |
| SCHEMBL27390160 | 0.69 | — | — | |
| SCHEMBL8620304 | 0.69 | — | — | |
| Acrylic Acid SCHEMBL29018599 | 0.69 | — | — | |
| SCHEMBL177716 | 0.67 | — | — | |
| SCHEMBL28671774 | 0.67 | — | — | |
| SCHEMBL220078 | 0.67 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114599644-B | Nicotinamide compound and herbicide composition containing the same | 韩国化学研究院 | 2024-08-02 | — | — | CN | disclosed |
| WO-2023109878-A1 | TRIAZASPIRO LPAR1 ANTAGONIST AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2023-06-22 | — | — | WO | disclosed |
| CN-114599644-A | Nicotinamide compound and herbicide composition containing the same | 韩国化学研究院 | 2022-06-07 | — | — | CN | disclosed |
| EP-3873893-A1 | 2-AMINO-N-HETEROARYL-NICOTINAMIDES AS NAV1.8 INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2021-09-08 | — | — | EP | disclosed |
| WO-2020025499-A1 | NEW COMPONENTS FOR ELECTROLYTE COMPOSITIONS | SOLVAY SA (BE) | 2020-02-06 | — | — | WO | disclosed |
| WO-2012025548-A1 | PROCESS FOR THE PREPARATION OF ALKENONES | SOLVAY SA (BE) | 2012-03-01 | — | — | WO | disclosed |
| EP-2352723-A2 | HALOGEN-SUBSTITUTED COMPOUNDS USED AS PESTICIDES | Bayer CropScience AG (DE) | 2011-08-10 | — | — | EP | disclosed |
| WO-2010051926-A2 | NEW HALOGEN-SUBSTITUTED BONDS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2010-05-14 | — | — | WO | disclosed |
| EP-2164831-A1 | METHOD FOR THE PRODUCTION OF N-SUBSTITUTED (3-DIHALOMETHYL-1-METHYL-PYRAZOLE-4-YL) CARBOXAMIDES | Basf Se (DE) | 2010-03-24 | — | — | EP | disclosed |
| WO-2008145740-A1 | METHOD FOR THE PRODUCTION OF N-SUBSTITUTED (3-DIHALOMETHYL-1-METHYL-PYRAZOLE-4-YL) CARBOXAMIDES | BASF SE (DE) | 2008-12-04 | — | — | WO | disclosed |