⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5694464 | 0.81 | — | — | |
| SCHEMBL50281 | 0.72 | — | — | |
| SCHEMBL5382199 | 0.65 | — | — | |
| SCHEMBL6974171 | 0.61 | — | — | |
| SCHEMBL3733761 | 0.45 | — | — | |
| SCHEMBL2404097 | 0.44 | — | — | |
| SCHEMBL29525411 | 0.43 | KDM4E (0.40) | — | |
| SCHEMBL29525891 | 0.43 | KDM4E (0.40) | — | |
| SCHEMBL22100500 | 0.42 | — | — | |
| Water SCHEMBL29123856 | 0.40 | KDM4E (0.46) | — |
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 5283 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-12637535-B2 | Non-ionic hydrophilized polyisocyanates having a very low monomer content | COVESTRO DEUTSCHLAND AG (DE) | 2026-05-26 | — | — | US | claimed |
| WO-2026104544-A1 | EXO-VINYLENE CARBONATE COMPOUNDS AS PRECURSORS FOR ISOCYANATE-FREE URETHANE-TYPE POLYMERS | BASF SE (DE) | 2026-05-21 | — | — | WO | claimed |
| EP-4745169-A1 | COMPOSITION USEFUL AS COATING, SEALANT OR ADHESIVE | BASF SE (DE) | 2026-05-20 | — | — | EP | claimed |
| EP-4745170-A1 | METHOD FOR PREPARING A URETHANE GROUP-CONTAINING POLYMER | BASF SE (DE) | 2026-05-20 | — | — | EP | claimed |
| EP-4114884-B1 | HIGH TEMPERATURE CROSS-LINKING DISPERSION | COVESTRO DEUTSCHLAND AG (DE) | 2026-05-13 | — | — | EP | claimed |
| EP-4731693-A1 | POLYISOCYANATE COMPOSITION | Covestro Deutschland AG (DE) | 2026-04-29 | — | — | EP | claimed |
| US-12612486-B2 | High-temperature cross-linking dispersion | COVESTRO DEUTSCHLAND AG (DE) | 2026-04-28 | — | — | US | claimed |
| WO-2025224257-A1 | SINGLE-COMPONENT COATING MATERIAL FOR FOOD CONTAINERS | COVESTRO DEUTSCHLAND AG (DE) | 2025-10-30 | — | — | WO | claimed |
| WO-2025224211-A1 | SINGLE-COMPONENT SYSTEM FOR COATINGS | COVESTRO DEUTSCHLAND AG (DE) | 2025-10-30 | — | — | WO | claimed |
| EP-4640731-A1 | ONE-COMPONENT COATING COMPOSITION FOR FOOD CONTAINERS | Covestro Deutschland AG (DE) | 2025-10-29 | — | — | EP | claimed |
| US-4443590-A | ISOCYANATE COMPONENT HAVING OXADIAZINETRIONE RING, ACTIVE HYDROGEN COMPONENT, LEWIS BASE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1984-04-17 | — | — | US | claimed |
| US-4443597-A | HAVING OXADIAZINETRIONE RINGS FROM REACTION OF BIS(ISOCYANATOMETHYL) CYCLOHEXANE AND CARBON DIOXIDE | TAKEDA CHEMICAL INDUSTRIES, INC. (JP) | 1984-04-17 | — | — | US | claimed |
| US-4412072-A | STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1983-10-25 | — | — | US | claimed |
| EP-0085776-A1 | Novel composition for polyurethane resins | Takeda Chemical Industries, Ltd. (JP) | 1983-08-17 | — | — | EP | claimed |
| EP-0081712-A1 | One-pack type thermosetting polyurethane coating composition | Takeda Chemical Industries, Ltd. (JP) | 1983-06-22 | — | — | EP | claimed |
| EP-0081693-A1 | Two-package type pressure-sensitive adhesive composition | Takeda Chemical Industries, Ltd. (JP) | 1983-06-22 | — | — | EP | claimed |
| EP-0081713-A2 | One-pack type thermosetting polyurethane coating composition | Takeda Chemical Industries, Ltd. (JP) | 1983-06-22 | — | — | EP | claimed |
| EP-0081103-A1 | One-can type pressure-sensitive adhesive composition | Takeda Chemical Industries, Ltd. (JP) | 1983-06-15 | — | — | EP | claimed |
| EP-0068454-A1 | Composition for polyurethane resins and production of the resins | Takeda Chemical Industries, Ltd. (JP) | 1983-01-05 | — | — | EP | claimed |
| EP-0043651-A2 | Polyisocyanates | Takeda Chemical Industries, Ltd. (JP) | 1982-01-13 | — | — | EP | claimed |