⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2784326 | 1.00 | — | — | |
| SCHEMBL7752906 | 1.00 | ALDH1A1 (0.41) | — | |
| Fluoride SCHEMBL2126927 | 0.97 | ALDH1A1 (0.39) | — | |
| SCHEMBL8725232 | 0.97 | — | — | |
| Fluoride SCHEMBL3190235 | 0.97 | — | — | |
| Iodide SCHEMBL11661272 | 0.94 | TDP1 (0.37) | — | |
| SCHEMBL11327854 | 0.91 | TDP1 (0.42) | — | |
| Acetic Acid Methyl Ester SCHEMBL29236065 | 0.84 | ALDH1A1 (0.50) | — | |
| SCHEMBL21811712 | 0.84 | ALDH1A1 (0.40) | — | |
| Methyl Isobutyl Ketone SCHEMBL722701 | 0.82 | ALDH1A1 (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
Appears in 5337 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12630491-B2 | Production of 2,2,4,4-tetramethylcyclobutane-1,3-diol from secondary alcohols and 2,2,4,4-tetramethylcyclobutanedione using homogeneous catalysts | EASTMAN CHEMICAL COMPANY (US) | 2026-05-19 | — | — | US | claimed |
| EP-3504196-B1 | PROCESSES FOR PREPARING OLAPARIB | SCINOPHARM TAIWAN LTD (TW) | 2026-04-08 | — | — | EP | claimed |
| US-20260076371-A1 | AGROCHEMICAL COMPOSITION OF TRIAZOLES | ADAMA MAKHTESHIM LTD. (IL) | 2026-03-19 | — | — | US | claimed |
| US-12578648-B2 | Rinsing liquid and pattern forming method | FUJIFILM CORPORATION (JP) | 2026-03-17 | — | — | US | claimed |
| US-20260026501-A1 | AGROCHEMICAL COMPOSITION OF SDHI FUNGICIDES | ADAMA MAKHTESHIM LTD. (IL) | 2026-01-29 | — | — | US | claimed |
| US-12509598-B2 | Process solution composition for polymer treatment comprising a fluorine compound, a ketone solvent, and a polar aprotic solvent | DONGWOO FINE-CHEM CO., LTD. (KR) | 2025-12-30 | — | — | US | claimed |
| US-12458918-B2 | Process and apparatus for treating methane-containing gas | KANADEVIA INOVA AG (CH) | 2025-11-04 | — | — | US | claimed |
| US-20250262588-A1 | PROCESS AND APPARATUS FOR TREATING METHANE-CONTAINING GAS | KANADEVIA INOVA AG (CH) | 2025-08-21 | — | — | US | claimed |
| EP-4035511-B1 | ELECTRICAL ENCLOSURE ASSEMBLY WITH AT LEAST ONE IT RACK OR ELECTRICAL ENCLOSURE HOUSING AND WITH AT LEAST ONE COOLING DEVICE, AND CORRESPONDING METHOD | RITTAL GMBH & CO KG (DE) | 2025-07-16 | — | — | EP | claimed |
| US-20250188383-A1 | PERFUME CONCRETE AND ABSOLUTE WHICH ARE OBTAINED BY KETONE OR DIOXOLANE-TYPE SOLVENT EXTRACTION FROM SOLID NATURAL SUBSTANCES | L'OREAL (FR) | 2025-06-12 | — | — | US | claimed |
| US-4454222-A | Process for forming resist patterns using mixed ketone developers | TOKYO SHIBAURA DENKI KABUSHIKI KAISHA (JP) | 1984-06-12 | — | — | US | claimed |
| US-4394521-A | Process for the production of the Schiff's bases of 2,6-dichloro-5-hydroxy-aniline | LONZA-WERKE G.M.B.H. (DE) | 1983-07-19 | — | — | US | claimed |
| EP-0064222-A2 | Process for forming resist patterns | KABUSHIKI KAISHA TOSHIBA (JP) | 1982-11-10 | — | — | EP | claimed |
| EP-0059457-A1 | Derivatives of norbornanes having hydrocarbon side chains, processes for preparing the same and perfume compositions containing the same | Nippon Petrochemicals Co., Ltd. (JP) | 1982-09-08 | — | — | EP | claimed |
| US-4243814-A | TO PRODUCE ALPHA-AMINOACIDS USING A KETONE AND HYDROXIDE IONS | PASCAL ROBERT | 1981-01-06 | — | — | US | claimed |
| US-4147721-A | Process for recovering methacrylic acid | HALCON RESEARCH AND DEVELOPMENT CORPORATION (US) | 1979-04-03 | — | — | US | claimed |
| US-4081482-A | Manufacture of 2,6,6-trimethyl-cyclohex-2-en-1-one | BASF AKTIENGESELLSCHAFT (DT) | 1978-03-28 | — | — | US | claimed |
| US-4067886-A | REACTING KETONES AND KETALS WITH HALOGEN | LEVER BROTHERS COMPANY (US) | 1978-01-10 | — | — | US | claimed |
| US-3992451-A | IN THE PRESENCE OF FREE RADICAL CATALYSTS, HYDROGEN CHLORIDE, AND CARBON MONOXIDE | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-11-16 | — | — | US | claimed |
| US-3935278-A | MOLYBDENUM OR VANADIUM CONTAINING CATALYST | ATLANTIC RICHFIELD COMPANY (US) | 1976-01-27 | — | — | US | claimed |