⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9816263 | 1.00 | KMT2A (0.52) | — | |
| SCHEMBL11230938 | 1.00 | KMT2A (0.52) | — | |
| SCHEMBL2948875 | 1.00 | KMT2A (0.52) | — | |
| SCHEMBL7530097 | 1.00 | KMT2A (0.52) | — | |
| SCHEMBL21495046 | 0.97 | — | — | |
| SCHEMBL918055 | 0.97 | — | — | |
| Ethylene SCHEMBL7388735 | 0.95 | KMT2A (0.48) | — | |
| SCHEMBL2342739 | 0.89 | — | — | |
| SCHEMBL13125935 | 0.75 | KMT2A (0.46) | — | |
| SCHEMBL1551749 | 0.74 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113773180-B | Method for synthesizing flea beetle aggregation pheromone | 中国农业大学 | 2022-07-26 | — | — | CN | disclosed |
| CN-113773180-A | Method for synthesizing flea beetle aggregation pheromone | 中国农业大学 | 2021-12-10 | — | — | CN | disclosed |
| US-20150307460-A1 | Substituted Triazoles and Imidazoles and Their Use as Fungicides | BASF SE (DE) | 2015-10-29 | — | — | US | disclosed |
| US-20150307460-A1 | Substituted Triazoles and Imidazoles and Their Use as Fungicides | BASF SE (DE) | 2015-10-29 | — | — | US | disclosed |
| US-20150307460-A1 | Substituted Triazoles and Imidazoles and Their Use as Fungicides | BASF SE (DE) | 2015-10-29 | — | — | US | disclosed |
| EP-2935224-A1 | NEW SUBSTITUTED TRIAZOLES AND IMIDAZOLES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2015-10-28 | — | — | EP | disclosed |
| WO-2014095547-A1 | NEW SUBSTITUTED TRIAZOLES AND IMIDAZOLES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2014-06-26 | — | — | WO | disclosed |
| WO-2014095547-A1 | NEW SUBSTITUTED TRIAZOLES AND IMIDAZOLES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2014-06-26 | — | — | WO | disclosed |
| US-20040267017-A1 | 3-pyridyl or 4-isoquinolinyl thiazoles as c17, 20 lyase inhibitors | BAYER PHARMACEUTICALS CORPORATION | 2004-12-30 | — | — | US | disclosed |
| EP-1463727-A2 | HETEROCYCLIC COMPOUNDS THAT ARE INHIBITORS OF THE ENZYME DPP-IV | NOVO NORDISK A/S (DK) | 2004-10-06 | — | — | EP | disclosed |
| WO-2004069831-A1 | TRICYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION | GLENMARK PHARMACEUTICALS LTD. (US) | 2004-08-19 | — | — | WO | disclosed |
| EP-1438290-A1 | CYCLOHEPT B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS | ELI LILLY AND COMPANY (US) | 2004-07-21 | — | — | EP | disclosed |
| EP-1432706-A2 | 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS | Bayer Pharmaceuticals Corporation (US) | 2004-06-30 | — | — | EP | disclosed |
| US-20030199528-A1 | Hetrocyclic compounds that are inhibitors of the enzyme DPP-IV | NOVO NORDISK A/S (DK) | 2003-10-23 | — | — | US | disclosed |
| WO-2003027085-A2 | 3-PYRIDYL OR 4-ISOQUINOLINYL THIAZOLES AS C17,20 LYASE INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |
| WO-2003024965-A2 | HETEROCYCLIC COMPOUNDS THAT ARE INHIBITORS OF THE ENZYME DPP-IV | NOVO NORDISK A/S (DK) | 2003-03-27 | — | — | WO | disclosed |
| WO-2003016277-A1 | CYCLOHEPT`B!INDOLE DERIVATIVES AS SPLA2 INHIBITORS | ELI LILLY AND COMPANY (US) | 2003-02-27 | — | — | WO | disclosed |