⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27872049 | 0.81 | — | — | |
| SCHEMBL14666320 | 0.78 | TDP1 (0.43) | — | |
| SCHEMBL15417150 | 0.78 | FAAH (0.35) | — | |
| SCHEMBL458908 | 0.78 | — | — | |
| SCHEMBL14304568 | 0.77 | — | — | |
| SCHEMBL13096844 | 0.77 | FAAH (0.36) | — | |
| SCHEMBL6902350 | 0.75 | FFAR3 (0.38) | — | |
| SCHEMBL8383362 | 0.75 | PDK1 (0.35) | — | |
| SCHEMBL13545176 | 0.75 | PDK1 (0.35) | — | |
| SCHEMBL121296 | 0.73 | — | — |
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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0010183-B1 | 3,3-BISFLUOROMETHYL-BUTAN-2-ONE AND PROCESS FOR ITS PREPARATION | BAYER AG (DE) | 1982-06-16 | — | — | EP | claimed |
| US-20230025932-A1 | NOVEL FUNCTIONALIZED LACTONES AS MODULATORS OF THE 5-HYDROXYTRYPTAMINE RECEPTOR 7 AND THEIR METHOD OF USE | PRAEVENTIX, LLC | 2023-01-26 | — | — | US | disclosed |
| EP-2399895-B1 | Process for producing optically active aliphatic fluoroalcohol | KANTO KAGAKU (JP) | 2018-08-08 | — | — | EP | disclosed |
| US-8629144-B2 | Polymorphic and hydrate forms, salts and process for preparing 6-{difluoro[6-(1-methyl-1H-pyrazol-4-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}quinoline | JANSSEN PHARMACEUTICA NV (BE) | 2014-01-14 | — | — | US | disclosed |
| US-8558033-B2 | Process for producing optically active aliphatic fluoroalcohol | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 2013-10-15 | — | — | US | disclosed |
| US-20110319671-A1 | PROCESS FOR PRODUCING OPTICALLY ACTIVE ALIPHATIC FLUOROALCOHOL | KANTO KAGAKU KABUSHIKI KAISHA (JP) | 2011-12-29 | — | — | US | disclosed |
| EP-2399895-A2 | Process for producing optically active aliphatic fluoroalcohol | Kanto Kagaku Kabushiki Kaisha (JP) | 2011-12-28 | — | — | EP | disclosed |
| US-7964650-B2 | Carbonyl-functionalized thiophene compounds and related device structures | NORTHWESTERN UNIVERSITY (US) | 2011-06-21 | — | — | US | disclosed |
| US-20090267061-A1 | Carbonyl-Functionalized Thiophene Compounds and Related Device Structures | POLYERA CORPORATION | 2009-10-29 | — | — | US | disclosed |
| US-7528176-B2 | organic field effect transistor device comprising semiconductor component (comprises a composition of thiophene-carbonyl compounds and polymer); enhanced solubility in a solvent and thermal stablity; promote electron and hole mobilities; in thermal analysis, molecular spectroscopy, electrochemistry | NORTHWESTERN UNIVERSITY (US) | 2009-05-05 | — | — | US | disclosed |
| US-4267381-A | SYNTHESIS OF FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1981-05-12 | — | — | US | disclosed |
| EP-0026856-A1 | Antimycotic agent containing an acylated imidazolyl-gamma-fluorpinacolyl derivative and its preparation | BAYER AG (DE) | 1981-04-15 | — | — | EP | disclosed |
| EP-0025948-A1 | Acylated imidazolyl-gamma-fluoropinacolyl derivatives, process for their preparation and their use as fungicides | BAYER AG (DE) | 1981-04-01 | — | — | EP | disclosed |
| EP-0025949-A1 | Acylated triazolyl-gamma-fluoropinacolyl derivatives, process for their preparation and their use as fungicides | BAYER AG (DE) | 1981-04-01 | — | — | EP | disclosed |
| EP-0019730-A1 | Antimycotic agent, process for its preparation | BAYER AG (DE) | 1980-12-10 | — | — | EP | disclosed |
| EP-0019134-A1 | Fluorinated 1-imidazolyl-butane derivatives, process for their preparation and their application as fungicides | BAYER AG (DE) | 1980-11-26 | — | — | EP | disclosed |
| EP-0019131-A1 | Fluorinated derivatives of 1-triazolyl butane, process for their preparation and their use as fungicides | BAYER AG (DE) | 1980-11-26 | — | — | EP | disclosed |
| EP-0019130-A1 | Antimycotic agents and process for preparing them | BAYER AG (DE) | 1980-11-26 | — | — | EP | disclosed |
| EP-0010183-A1 | 3,3-bisfluoromethyl-butan-2-one and process for its preparation | BAYER AG (DE) | 1980-04-30 | — | — | EP | disclosed |
| EP-0010183-A1 | 3,3-bisfluoromethyl-butan-2-one and process for its preparation | BAYER AG (DE) | 1980-04-30 | — | — | EP | disclosed |