⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27898707 | 0.95 | — | — | |
| Ethylene SCHEMBL27789951 | 0.75 | — | — | |
| Ethylene SCHEMBL28788682 | 0.74 | — | — | |
| Ethylene SCHEMBL27836919 | 0.74 | — | — | |
| SCHEMBL6904629 | 0.60 | — | — | |
| SCHEMBL10592329 | 0.57 | — | — | |
| SCHEMBL27623082 | 0.57 | KCNA4 (0.30) | — | |
| Ethylene SCHEMBL4859543 | 0.50 | — | — | |
| Nitric Acid SCHEMBL22117373 | 0.49 | CA5A (0.67) | — | |
| Nitric Acid SCHEMBL27964677 | 0.49 | CA5A (0.67) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105503487-A | Nanometer flaky 1,1-diamido-2,2-binitro ethylene explosive and preparation method thereof | INST CHEMICAL MAT CHINA ACAD ENG PHYSICS | 2016-04-20 | — | — | CN | claimed |
| CN-105111090-A | Method for continuous preparation of 1,1-diamino-2,2-dinitroethylene | UNIV NANJING SCIENCE & TECH | 2015-12-02 | — | — | CN | claimed |
| CN-104672156-A | 2-methyl-4-nitro-1,2,3-triazolyl-5-ammonia, and preparation method and application thereof | UNIV NORTHWESTERN | 2015-06-03 | — | — | CN | claimed |
| CN-104591934-A | High-temperature-resistant propellant for deep oil-gas well and preparation method thereof | XIAN MODERN CHEMISTRY RES INST | 2015-05-06 | — | — | CN | claimed |
| CN-104387280-A | Method for preparing 1,1-diamido-2,2-binitroethylene at normal temperature | UNIV NANJING SCIENCE & TECH | 2015-03-04 | — | — | CN | claimed |
| CN-102161628-B | Preparation method and application of 1-amino-1-hydrazino-2,2-dinitroethylene bismuth salt | UNIV SHANXI NORMAL | 2014-01-15 | — | — | CN | claimed |
| CN-102161628-A | Preparation method and application of 1-amino-1-hydrazino-2,2-dinitroethylene bismuth salt | UNIV SHANXI NORMAL | 2011-08-24 | — | — | CN | claimed |
| CN-101130644-A | Orderly self-assembled and formed composite material containing energy of organic molecule and method of producing the same | UNIV FUDAN (CN) | 2008-02-27 | — | — | CN | claimed |
| CN-105503487-A | Nanometer flaky 1,1-diamido-2,2-binitro ethylene explosive and preparation method thereof | INST CHEMICAL MAT CHINA ACAD ENG PHYSICS | 2016-04-20 | — | — | CN | disclosed |
| CN-105111090-A | Method for continuous preparation of 1,1-diamino-2,2-dinitroethylene | UNIV NANJING SCIENCE & TECH | 2015-12-02 | — | — | CN | disclosed |
| CN-104672156-A | 2-methyl-4-nitro-1,2,3-triazolyl-5-ammonia, and preparation method and application thereof | UNIV NORTHWESTERN | 2015-06-03 | — | — | CN | disclosed |
| CN-104649850-A | High polymer bonded explosive enhancing mechanical properties with nanoparticles and preparation method of high polymer bonded explosive | INST CHEMICAL MATERIAL CHINA ACADEMY ENGINEERING PHYSICS | 2015-05-27 | — | — | CN | disclosed |
| CN-104591934-A | High-temperature-resistant propellant for deep oil-gas well and preparation method thereof | XIAN MODERN CHEMISTRY RES INST | 2015-05-06 | — | — | CN | disclosed |
| CN-104387280-A | Method for preparing 1,1-diamido-2,2-binitroethylene at normal temperature | UNIV NANJING SCIENCE & TECH | 2015-03-04 | — | — | CN | disclosed |
| CN-102161628-B | Preparation method and application of 1-amino-1-hydrazino-2,2-dinitroethylene bismuth salt | UNIV SHANXI NORMAL | 2014-01-15 | — | — | CN | disclosed |
| CN-102952077-A | Preparation method and performance calculation for 2-(dinitromethyl)-3-nitro-1,3-diazacyclo-pent-1-ene ionic salt containing energy | BEIJING INST TECHNOLOGY | 2013-03-06 | — | — | CN | disclosed |
| CN-102161628-A | Preparation method and application of 1-amino-1-hydrazino-2,2-dinitroethylene bismuth salt | UNIV SHANXI NORMAL | 2011-08-24 | — | — | CN | disclosed |
| CN-101130644-A | Orderly self-assembled and formed composite material containing energy of organic molecule and method of producing the same | UNIV FUDAN (CN) | 2008-02-27 | — | — | CN | disclosed |