⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6032251 | 0.72 | — | — | |
| SCHEMBL84475 | 0.71 | — | — | |
| SCHEMBL12322618 | 0.69 | — | — | |
| SCHEMBL8038752 | 0.69 | — | — | |
| SCHEMBL6438758 | 0.69 | — | — | |
| SCHEMBL737802 | 0.67 | — | — | |
| SCHEMBL5584926 | 0.67 | — | — | |
| SCHEMBL40928 | 0.65 | — | — | |
| SCHEMBL356856 | 0.64 | — | — | |
| SCHEMBL83693 | 0.64 | — | — |
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-108329304-B | Preparation method of itraconazole derivative | 梯尔希（南京）药物研发有限公司 | 2020-12-08 | — | — | CN | claimed |
| US-5206149-A | Reaction of peroxidase, oxidant, luminol and 2-hydroxy-9-fluorenone enhancer; chemiluminescence | TORAY INDUSTRIES, INC. (JP) | 1993-04-27 | — | — | US | claimed |
| CN-108329304-B | Preparation method of itraconazole derivative | 梯尔希（南京）药物研发有限公司 | 2020-12-08 | — | — | CN | disclosed |
| CN-107004906-B | Magnesium-containing electrolyte | 富士胶片和光纯药株式会社 | 2020-04-21 | — | — | CN | disclosed |
| CN-104945382-B | Substituted piperidines that increase p53 activity and uses thereof | 默沙东公司 | 2020-02-07 | — | — | CN | disclosed |
| CN-105764885-B | The production method of acid and free-radical generating agent and acid and free radical | 富士胶片和光纯药株式会社 | 2018-11-09 | — | — | CN | disclosed |
| CN-108026230-A | Antifouling composition | 巴斯夫欧洲公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-107922571-A | Antifouling composition | 巴斯夫欧洲公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-107004906-A | Magnesium-containing electrolyte | 和光纯药工业株式会社 | 2017-08-01 | — | — | CN | disclosed |
| CN-104780923-B | Interferon Inducer Compounds | 葛兰素史克有限责任公司 | 2017-03-15 | — | — | CN | disclosed |
| CN-105764885-A | Acid- and radical-generating agent and method for generating acid and radical | 和光纯药工业株式会社 | 2016-07-13 | — | — | CN | disclosed |
| CN-101511171-B | Stable suspension noxious organism control agent | NIPPON SODA CO.,LTD. (JP) | 2015-11-25 | — | — | CN | disclosed |
| CN-1849302-A | 1, 3-disubstituted azetidine derivatives useful as CCR-3 receptor antagonists in the treatment of inflammatory and allergic diseases | NOVARTIS AG (CH) | 2006-10-18 | — | — | CN | disclosed |
| EP-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |
| CN-1024798-C | Process for preparing novel basic substituted 5-halo-thienoisothiazol-3 (2H) -one 1, 1-dioxides | CHEM PHARM FORSCH GMBH (AT) | 1994-06-01 | — | — | CN | disclosed |
| CN-1038646-A | 5-halo-thienoisothiazole-3 (2H)-ketone 1 that new basic group replaces, 1-dioxide, their preparation method and the pharmaceutical preparation that comprises these compounds | CHEM PHARM FORSCH GMBH (AT) | 1990-01-10 | — | — | CN | disclosed |