⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4847965 | 0.97 | TP53 (0.48) | — | |
| Ammonia Solution, Strong SCHEMBL958345 | 0.97 | TP53 (0.48) | — | |
| Ethylene SCHEMBL27607024 | 0.94 | TP53 (0.46) | — | |
| Bromide SCHEMBL8209119 | 0.94 | TP53 (0.46) | — | |
| Formaldehyde SCHEMBL27868886 | 0.92 | ALDH1A1 (0.46) | — | |
| Methoxymethane SCHEMBL27325845 | 0.92 | IDO1 (0.46) | — | |
| SCHEMBL2479806 | 0.92 | MAPK1 (0.48) | — | |
| SCHEMBL17166204 | 0.87 | TAAR1 (0.45) | — | |
| SCHEMBL12514357 | 0.87 | TAAR1 (0.45) | — | |
| SCHEMBL12514351 | 0.85 | MEN1 (0.40) | — |
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 2134 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 |
|---|---|---|---|---|---|---|---|
| CN-116535279-B | Continuous and intermittent method for carbon nitride photoactivation molecular oxygen solvent-free oxidation of aromatic C-H bond | 大连理工大学 | 2024-11-26 | — | — | CN | claimed |
| CN-115636726-B | Method for producing hydrogen and oxygen-containing organic matter by virtue of economic reaction of visible light catalytic hydrocarbon compound and water source at normal temperature | 湖南师范大学 | 2024-05-10 | — | — | CN | claimed |
| CN-116063209-B | Method for preparing benzylamine derivative by catalyzing amination of benzyl C-H bond through nickel under promotion of visible light | 上海沃凯生物技术有限公司 | 2024-04-09 | — | — | CN | claimed |
| CN-117816241-A | Palladium-containing catalyst, preparation method and application thereof, and Suzuki-Miyaura reaction method | 中国石油化工股份有限公司 | 2024-04-05 | — | — | CN | claimed |
| CN-117264211-A | Low-melting-point polyarylene sulfide resin and film, and preparation methods and applications thereof | 新凝合科技(成都)有限公司 | 2023-12-22 | — | — | CN | claimed |
| CN-113694968-B | Palladium-loaded magnetic UiO-66 ternary composite catalytic material, and preparation method and application thereof | 常州大学 | 2023-09-26 | — | — | CN | claimed |
| CN-112920813-B | Photo-thermal response chiral photosensitive liquid crystal dopant containing azobenzene binaphthyl | 湘潭大学 | 2023-08-22 | — | — | CN | claimed |
| CN-114907344-B | Beta-carboline-1-propionic acid and indole derivatives, and preparation method and application thereof | 山东大学 | 2023-06-30 | — | — | CN | claimed |
| CN-115636726-A | Method for producing hydrogen and oxygen-containing organic matters through economic reaction of hydrocarbon compounds and water atoms under visible light catalysis at normal temperature | 湖南师范大学 | 2023-01-24 | — | — | CN | claimed |
| CN-111793334-B | PET film and preparation method thereof | 圆创享(苏州)新材料技术有限公司 | 2023-01-10 | — | — | CN | claimed |
| US-6127381-A | A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY | LION BIOSCIENCE AG (DE) | 2000-10-03 | — | — | US | claimed |
| WO-2000045635-A1 | THIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2000-08-10 | — | — | WO | claimed |
| WO-1999055679-A1 | ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME | TREGA BIOSCIENCES, INC. (US) | 1999-11-04 | — | — | WO | claimed |
| US-5908960-A | Compounds | SMITHKLINE BEECHAM CORPORATION (US) | 1999-06-01 | — | — | US | claimed |
| EP-0903338-A2 | Synthesis of stable nitrile oxide compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1999-03-24 | — | — | EP | claimed |
| US-5786448-A | FOR SCREENING, SYNTHESIZING PEPTIDE DERIVATIVES | TREGA BIOSCIENCES, INC. (US) | 1998-07-28 | — | — | US | claimed |
| WO-1998019693-A1 | COMBINATORIAL LIBRARIES OF CYCLIC UREA AND CYCLIC THIOUREA DERIVATIVES AND COMPOUNDS THEREIN | TREGA BIOSCIENCES, INC. (US) | 1998-05-14 | — | — | WO | claimed |
| US-5486529-A | Certain pyridyl ketones for treating diseases involving leukocyte elastase | ZENECA LIMITED (GB) | 1996-01-23 | — | — | US | claimed |
| US-5380910-A | Dehalogeno coupling | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 1995-01-10 | — | — | US | claimed |
| US-4643807-A | Process for electrochemically forming an aromatic compound containing one or more alpha-acyloxylated aliphatic substitutent(s) | THE DOW CHEMICAL COMPANY (US) | 1987-02-17 | — | — | US | claimed |