⚠ 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL12475625 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclopentane SCHEMBL29088065 | 1.00 | — | — | |
| Cyclohexane SCHEMBL21879029 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclohexane SCHEMBL11489570 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclohexane SCHEMBL12475806 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclohexane SCHEMBL5712062 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclohexane SCHEMBL12476090 | 1.00 | ALDH1A1 (0.57) | — | |
| Cyclohexane SCHEMBL2166732 | 0.94 | ALDH1A1 (0.50) | — | |
| Cyclohexane SCHEMBL11683239 | 0.84 | ALDH1A1 (0.40) | — | |
| Cyclohexane SCHEMBL4728225 | 0.84 | ALDH1A1 (0.40) | — |
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 930 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116987088-A | Metalloporphyrin containing hexafluoropropylene trimer functional group, and preparation method and application thereof | 浙江工业大学 | 2023-11-03 | — | — | CN | claimed |
| CN-116510784-A | Metal carbonyl-based polymetallic complex catalyst and preparation method and application thereof | 中国科学院大连化学物理研究所 | 2023-08-01 | — | — | CN | claimed |
| CN-113980044-B | Preparation method of Ir-O-P type catalyst diboronic acid/ester compound | 西安交通大学 | 2023-02-03 | — | — | CN | claimed |
| CN-110498766-B | Fluazinam hapten, artificial antigen and antibody, and preparation method and application thereof | 北京勤邦生物技术有限公司 | 2022-07-08 | — | — | CN | claimed |
| CN-114456191-A | Extraction method and application of tocopherol derivatives of overground parts of Chinese yam | 新乡医学院 | 2022-05-10 | — | — | CN | claimed |
| CN-113980044-A | Preparation method of Ir-O-P type catalyst diboronic acid/ester compound | 西安交通大学 | 2022-01-28 | — | — | CN | claimed |
| CN-112812574-A | Preparation method of high-thermal-conductivity boron nitride modified styrene butadiene rubber | 宁波伟裕工贸有限公司 | 2021-05-18 | — | — | CN | claimed |
| CN-110698509-B | Triphenylamine derivative electrochromic composite material and preparation method thereof | 华南理工大学 | 2021-03-30 | — | — | CN | claimed |
| CN-109111359-B | Method for preparing Amorfrutin A and Amorfrutin B from amorpha fruticosa fruits | 陕西嘉禾药业有限公司 | 2021-03-30 | — | — | CN | claimed |
| CN-110759953-B | Ferrocene-improved triphenylamine derivative electrochromic composite material and preparation method thereof | 华南理工大学 | 2020-12-22 | — | — | CN | claimed |
| EP-1994013-A4 | PROCESS FOR PRODUCING PURE AND STABLE FORM OF 2-METHYL-4-(4- METHYL- 1 -PIPERAZINYL)-10H-THIENO[2,3-b] [1,5]BENZODIAZEPINE | JUBILANT ORGANOSYS LTD (IN) | 2009-04-01 | — | — | EP | claimed |
| US-7485663-B2 | Carvedilol | TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) | 2009-02-03 | — | — | US | claimed |
| EP-1994013-A1 | PROCESS FOR PRODUCING PURE AND STABLE FORM OF 2-METHYL-4-(4- METHYL- 1 -PIPERAZINYL)-10H-THIENO[2,3-b] [1,5]BENZODIAZEPINE | Jubilant Organosys Limited (IN) | 2008-11-26 | — | — | EP | claimed |
| WO-2007105225-A1 | PROCESS FOR PRODUCING PURE AND STABLE FORM OF 2-METHYL-4-(4- METHYL- 1 -PIPERAZINYL)-10H-THIENO[2,3-b] [ 1,5]BENZODIAZEPINE | JUBILANT ORGANOSYS LIMITED (IN) | 2007-09-20 | — | — | WO | claimed |
| CN-1939472-A | Quality control of compound preparation for treating diabetes | QIYUANYIDE DRUG INST BEIJING (CN) | 2007-04-04 | — | — | CN | claimed |
| US-7009013-B2 | Process for producing crystalline 1,2-polybutadiene | JSR CORPORATION (JP) | 2006-03-07 | — | — | US | claimed |
| US-20040225132-A1 | Carvedilol | HILDESHEIM JEAN (IL) | 2004-11-11 | — | — | US | claimed |
| US-6756502-B2 | AS CHEMICAL INTERMEDIATE IN PREPARATION OF VENLAFAXINE | ALEMBIC LIMITED (IN) | 2004-06-29 | — | — | US | claimed |
| US-20030195376-A1 | Novel intermediate and processes for its preparation and conversion into a pharmacologically-active agent | ALEMBIC LIMITED (A CORPORATION OF INDIA) (IN) | 2003-10-16 | — | — | US | claimed |
| US-20020143045-A1 | Carvedilol | TEVA PHARMACEUTICALS USA, INC. | 2002-10-03 | — | — | US | claimed |