⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL66336 | 0.82 | ALDH1A1 (0.50) | — | |
| Diethanolamine SCHEMBL16879890 | 0.79 | ALDH1A1 (0.64) | — | |
| SCHEMBL12904575 | 0.79 | ALDH1A1 (0.43) | — | |
| SCHEMBL28846230 | 0.77 | ALDH1A1 (0.52) | — | |
| Diethanolamine SCHEMBL11818824 | 0.77 | ALDH1A1 (0.56) | — | |
| Ethyl Acetate SCHEMBL9742135 | 0.76 | ALDH1A1 (0.58) | — | |
| SCHEMBL21184226 | 0.76 | PAOX (0.43) | — | |
| SCHEMBL20444223 | 0.75 | ALDH1A1 (0.43) | — | |
| SCHEMBL17039445 | 0.75 | — | — | |
| SCHEMBL28017420 | 0.74 | MAPT (0.38) | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119997951-A | Method for preventing, alleviating and/or treating PTGS 2-induced skin disorders and related dysfunctions | 西姆莱斯股份公司 | 2025-05-13 | — | — | CN | disclosed |
| CN-119968452-A | Perfume mixture (VI) | 西姆莱斯股份公司 | 2025-05-09 | — | — | CN | disclosed |
| CN-119790128-A | Perfume mixture (III) | 西姆莱斯股份公司 | 2025-04-08 | — | — | CN | disclosed |
| CN-119744164-A | Odor and colorant stable compositions | 西姆莱斯股份公司 | 2025-04-01 | — | — | CN | disclosed |
| CN-119604270-A | Comprising an antimicrobial agent accelerator composition | 西姆莱斯股份公司 | 2025-03-11 | — | — | CN | disclosed |
| CN-114728092-B | Edge block with improved odor performance | 西姆莱斯股份公司 | 2025-02-28 | — | — | CN | disclosed |
| CN-119486725-A | (2E) Mixtures and uses of (E) -3- (1, 3-benzodioxol-5-yl) -N-phenyl-N- (tetrahydro-3-furanyl) -2-propenamide | 西姆莱斯有限公司 | 2025-02-18 | — | — | CN | disclosed |
| CN-119317696-A | Perfume mixture (V) | 西姆莱斯股份公司 | 2025-01-14 | — | — | CN | disclosed |
| CN-119317695-A | Perfume mixture (V) | 西姆莱斯股份公司 | 2025-01-14 | — | — | CN | disclosed |
| CN-119255980-A | Perfume with cyclopropyl structure | 西姆莱斯股份公司 | 2025-01-03 | — | — | CN | disclosed |
| CN-116685300-A | Composition comprising one or more (bio) -alkanediols with an antioxidant | 西姆莱斯股份公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-116615172-A | Composition comprising a natural polymer and one or more (bio) alkanediols | 西姆莱斯股份公司 | 2023-08-18 | — | — | CN | disclosed |
| CN-116583261-A | Method for combating microorganisms using menthol derivatives | 西姆莱斯股份公司 | 2023-08-11 | — | — | CN | disclosed |
| CN-116490160-A | A mixture containing 1, 2-alkanediol | 西姆莱斯股份公司 | 2023-07-25 | — | — | CN | disclosed |
| CN-113543637-B | Antimicrobial mixture | 西姆莱斯股份公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-114728254-A | Polyurea microcapsules and liquid surfactant system containing the same | 西姆莱斯股份公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-114727914-A | Product for the indirect transfer of a cosmetic active to the skin | 西姆莱斯股份公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-114728092-A | Edge block with improved odor performance | 西姆莱斯股份公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-114364773-A | Aromatic oil mixture | 西姆莱斯股份公司 | 2022-04-15 | — | — | CN | disclosed |
| CN-113993500-A | Cool preparation | 德国德之馨香精香料公司 | 2022-01-28 | — | — | CN | disclosed |