⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14483430 | 0.69 | — | — | |
| SCHEMBL9477459 | 0.65 | — | — | |
| SCHEMBL9477466 | 0.65 | — | — | |
| SCHEMBL11735381 | 0.64 | — | — | |
| SCHEMBL9475673 | 0.63 | — | — | |
| SCHEMBL9331577 | 0.63 | — | — | |
| SCHEMBL8535520 | 0.60 | — | — | |
| SCHEMBL436234 | 0.60 | — | — | |
| SCHEMBL184925 | 0.58 | — | — | |
| SCHEMBL438196 | 0.57 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0277317-B1 | NITRO DERIVATIVES OF 2-IMINOIMIDAZOLIDINES AND 2-IMINOTETRAHYDROPYRIMIDINES | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1991-04-03 | — | — | EP | claimed |
| US-8962229-B2 | Electrostatic charge image developing toner, electrostatic charge image developer, toner cartridge, process cartridge, image forming apparatus, and image forming method | FUJI XEROX CO., LTD. (JP) | 2015-02-24 | — | — | US | disclosed |
| CN-103896927-A | Method for preparing (R)/(S)-1-(2,3-glycidyl)-N-nitroimidazoline-2-imine | WUHAN INST TECHNOLOGY | 2014-07-02 | — | — | CN | disclosed |
| US-20140134526-A1 | ELECTROSTATIC CHARGE IMAGE DEVELOPING TONER, ELECTROSTATIC CHARGE IMAGE DEVELOPER, TONER CARTRIDGE, PROCESS CARTRIDGE, IMAGE FORMING APPARATUS, AND IMAGE FORMING METHOD | FUJI XEROX CO., LTD. (JP) | 2014-05-15 | — | — | US | disclosed |
| US-5360906-A | N-(3-halo-5-isoxazolylmethyl)-2-nitromethylene- and -2-nitroimino-imidazolines and pyrimidines; aminoalkylation, cyclization | SHELL RESEARCH LIMITED (GB) | 1994-11-01 | — | — | US | disclosed |
| EP-0555931-A1 | Isoxazole derivatives and their use as pesticides | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1993-08-18 | — | — | EP | disclosed |