⚠ 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 | |
|---|---|---|---|---|
| Acetone SCHEMBL3859411 | 0.84 | — | — | |
| Acetone SCHEMBL18875610 | 0.80 | — | — | |
| Acetone SCHEMBL304055 | 0.80 | — | — | |
| Acetone SCHEMBL1603144 | 0.80 | — | — | |
| Acetone SCHEMBL3247372 | 0.78 | — | — | |
| Acetone SCHEMBL10051950 | 0.78 | — | — | |
| Acetone SCHEMBL528137 | 0.78 | LMNA (1.00) | — | |
| Acetone SCHEMBL662 | 0.78 | — | — | |
| Acetone SCHEMBL5665105 | 0.78 | LMNA (1.00) | — | |
| Acetone SCHEMBL7459124 | 0.78 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115279730-B | 2, 5-Or 2, 6-disubstituted hydroquinone derivatives having at least one carboxyl, sulfo or amido group, useful as medicaments | OM药物公司 | 2025-02-14 | — | — | CN | disclosed |
| CN-119301121-A | Pyrimidin-2-yl-pyrazole compounds as IRAK inhibitors | 里格尔药品股份有限公司 | 2025-01-10 | — | — | CN | disclosed |
| CN-118891243-A | RXR agonist salt forms, polymorphs thereof and uses thereof | IO治疗公司 | 2024-11-01 | — | — | CN | disclosed |
| EP-4343889-A1 | NANO-SILICON-OXYGEN-CARBON STRUCTURE COMPOSITE MATERIAL AND PREPARATION METHOD THEREFOR, NEGATIVE ELECTRODE AND ELECTROCHEMICAL DEVICE | Lanxi Zhide Advanced Materials Co., Ltd. (CN) | 2024-03-27 | — | — | EP | disclosed |
| CN-117412649-A | Organometallic compound, light-emitting device, electronic apparatus, and electronic device | 三星显示有限公司 | 2024-01-16 | — | — | CN | disclosed |
| CN-110099899-B | Oxazole derivatives useful as IRAK inhibitors and process for their preparation | 里格尔药品股份有限公司 | 2024-01-02 | — | — | CN | disclosed |
| WO-2023172034-A1 | PHARMACEUTICAL COMPOSITION FOR PREVENTING AND TREATING ENVELOPED VIRUSES, COMPRISING EXTRACTS OF CODONOPSIS SP., ASTER SP. AND/OR POLYGALA SP. PLANTS | 기초과학연구원 | 2023-09-14 | — | — | WO | disclosed |
| WO-2023142985-A1 | PREPARATION METHOD FOR TGF-β-INHIBITING ANTI-TUMOR DRUG | 四川科伦博泰生物医药股份有限公司 | 2023-08-03 | — | — | WO | disclosed |
| CN-116033941-A | Pentavalent vaccine against neisseria meningitidis comprising synthetic MEN a antigen | 葛兰素史克生物有限公司 | 2023-04-28 | — | — | CN | disclosed |
| WO-2023038480-A1 | COMPOSITION, FOR PREVENTING, TREATING OR RELIEVING INFLUENZA VIRUS INFECTION, COMPRISING MIXTURE OF AGRIMONIA PILOSA EXTRACT AND GALLA RHOIS EXTRACT AS ACTIVE INGREDIENT | 에이피알지 주식회사 | 2023-03-16 | — | — | WO | disclosed |
| CN-111196816-B | Seven-membered ring compound and application thereof in preventing and treating diabetes and metabolic syndrome | 中国科学院上海药物研究所 | 2022-11-04 | — | — | CN | disclosed |
| CN-115279730-A | 2, 5-or 2, 6-disubstituted hydroquinone derivatives having at least one carboxyl, sulfo or amido group useful as medicaments | OM药物公司 | 2022-11-01 | — | — | CN | disclosed |
| WO-2022220518-A1 | SULFATE OF 5-[(1,1-DIOXIDO-4-THIOMORPHOLINYL)METHYL]-2-PHENYL-N-(TETRAHYDRO-2H-PYRAN-4-YL)-1H-INDOLE-7-AMINE, AND NOVEL CRYSTAL FORM THEREOF | 주식회사 미토이뮨테라퓨틱스 | 2022-10-20 | — | — | WO | disclosed |
| US-4364866-A | ANTIBIOTICS, ANTIPROTOZOA, ANTITUMOR | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-12-21 | — | — | US | disclosed |