⚠ 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL3422401 | 0.91 | CA5A (0.44) | — | |
| SCHEMBL4113336 | 0.88 | TSHR (0.40) | — | |
| SCHEMBL6124295 | 0.88 | TSHR (0.40) | — | |
| SCHEMBL27921389 | 0.83 | — | — | |
| SCHEMBL14871988 | 0.79 | ALDH1A1 (0.42) | — | |
| SCHEMBL5069837 | 0.77 | CYP3A4 (0.33) | — | |
| SCHEMBL5072598 | 0.75 | ALDH1A1 (0.34) | — | |
| SCHEMBL28115043 | 0.75 | TSHR (0.40) | — | |
| Nitric Acid SCHEMBL28138340 | 0.74 | ALDH1A1 (0.38) | — | |
| SCHEMBL7074066 | 0.73 | — | — |
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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118922206-A | Neutralization of acetyl-CoA binding proteins confers autophagy-dependent organ protection | 国家医疗保健研究所 | 2024-11-08 | — | — | CN | claimed |
| CN-114394641-A | Method for adsorbing nitrosodiethylamine in water based on modified activated carbon | 江西农业大学 | 2022-04-26 | — | — | CN | claimed |
| CN-111453882-A | Tail gas circulating water treatment method for density board production line | 香河众旺木业有限公司 | 2020-07-28 | — | — | CN | claimed |
| EP-1185503-B1 | METHOD FOR PRODUCING DINITRO-DIAZA-ALKANES AND INTERMEDIATE PRODUCTS HERETO | NITROCHEMIE GMBH (DE) | 2004-07-14 | — | — | EP | claimed |
| CN-114711391-B | Fermented meat product and preparation method thereof | 河南农业大学 | 2024-01-23 | — | — | CN | disclosed |
| CN-115557852-A | Synthesis method of 1, 5-diazido-3-nitroazapentane | 西安近代化学研究所 | 2023-01-03 | — | — | CN | disclosed |
| US-11193110-B2 | Methods to generate gastrointestinal epithelial tissue constructs | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2021-12-07 | — | — | US | disclosed |
| CN-111655843-A | NK or T cells and uses thereof | 博爱米拉索勒股份公司 | 2020-09-11 | — | — | CN | disclosed |
| CN-109030539-A | A kind of method of nuclear magnetic resonance hydrogen spectruming determining 1,5- diazido -3- nitro -3- aza-pentane moisture content | 西安近代化学研究所 | 2018-12-18 | — | — | CN | disclosed |
| US-9914734-B2 | Cyclic energetic nitramines desensitized with linear nitramines | AEROJET ROCKETOYNE, INC. (US) | 2018-03-13 | — | — | US | disclosed |
| US-20180002672-A1 | METHODS TO GENERATE GASTROINTESTINAL EPITHELIAL TISSUE CONSTRUCTS | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL | 2018-01-04 | — | — | US | disclosed |
| EP-3250678-A1 | METHODS TO GENERATE GASTROINTESTINAL EPITHELIAL TISSUE CONSTRUCTS | The University of North Carolina at Chapel Hill (US) | 2017-12-06 | — | — | EP | disclosed |
| WO-1999021808-A1 | ENERGETIC OXETANE PROPELLANTS | CORDANT TECHNOLOGIES, INC. (US) | 1999-05-06 | — | — | WO | disclosed |
| EP-0904531-A1 | METHOD OF EXPLOSIVES DETECTION | THE SECRETARY OF STATE FOR DEFENCE (GB) | 1999-03-31 | — | — | EP | disclosed |
| EP-0861268-A1 | INHIBITORY AND NON-INHIBITORY ANTIGEN BINDING POLYPEPTIDES AGAINST HUMAN P450 ENZYMES | THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1998-09-02 | — | — | EP | disclosed |
| WO-1997047958-A1 | METHOD OF EXPLOSIVES DETECTION | THE SECRETARY OF STATE FOR DEFENCE (GB) | 1997-12-18 | — | — | WO | disclosed |
| WO-1997019112-A1 | INHIBITORY AND NON-INHIBITORY ANTIGEN BINDING POLYPEPTIDES AGAINST HUMAN P450 ENZYMES | UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1997-05-29 | — | — | WO | disclosed |
| US-5520757-A | Low vulnerability propellants | ICI EXPLOSIVES USA INC. (US) | 1996-05-28 | — | — | US | disclosed |
| US-5482581-A | Low vulnerability propellant plasticizers | ICI EXPLOSIVES USA INC. (US) | 1996-01-09 | — | — | US | disclosed |
| US-3973910-A | Method of measuring the N-nitrosoamine content of a sample | THERMO ELECTRON CORPORATION (US) | 1976-08-10 | — | — | US | disclosed |