⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6841419 | 0.91 | — | — | |
| SCHEMBL28493769 | 0.88 | TSHR (0.48) | — | |
| SCHEMBL27564346 | 0.88 | TSHR (0.48) | — | |
| SCHEMBL9308288 | 0.88 | — | — | |
| SCHEMBL2633972 | 0.88 | TSHR (0.48) | — | |
| SCHEMBL352537 | 0.80 | — | — | |
| SCHEMBL55298 | 0.79 | — | — | |
| SCHEMBL8922111 | 0.79 | — | — | |
| SCHEMBL4600942 | 0.79 | — | — | |
| SCHEMBL7736558 | 0.76 | TSHR (0.50) | — |
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 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114196187-B | Preparation method of graphene grafted POSS (polyhedral oligomeric silsesquioxane) synergetic flame-retardant polycarbonate composite material | 福建腾博新材料科技有限公司 | 2023-03-28 | — | — | CN | claimed |
| CN-114196187-A | Preparation method of graphene grafted POSS (polyhedral oligomeric silsesquioxane) synergetic flame-retardant polycarbonate composite material | 曹苗苗 | 2022-03-18 | — | — | CN | claimed |
| CN-102076700-A | Production method for a linear or cyclic trisilaalkane | SAMSUNG FINE CHEMICALS CO LTD | 2011-05-25 | — | — | CN | claimed |
| WO-2024067719-A1 | TRIFLUOROMETHYL ORGANOSILICON OXACYCLOALKANE MONOMER, AND PREPARATION AND USE THEREOF | 湖北固润科技股份有限公司 | 2024-04-04 | — | — | WO | disclosed |
| CN-117534823-A | Copolycarbonate and preparation method thereof | 万华化学集团股份有限公司 | 2024-02-09 | — | — | CN | disclosed |
| CN-113527079-B | Method for preparing 2-isopropenyl-5-methyl-4-hexenoic acid and derivative alcohol and carboxylic ester thereof | 信越化学工业株式会社 | 2023-11-14 | — | — | CN | disclosed |
| CN-116143692-A | Compounds, products and methods for determining the content or presence of vitamin D | 科美博阳诊断技术(上海)有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-111518005-B | Intermediate compound and preparation method and application thereof | 科美博阳诊断技术(上海)有限公司 | 2023-04-11 | — | — | CN | disclosed |
| CN-114196187-B | Preparation method of graphene grafted POSS (polyhedral oligomeric silsesquioxane) synergetic flame-retardant polycarbonate composite material | 福建腾博新材料科技有限公司 | 2023-03-28 | — | — | CN | disclosed |
| CN-114196187-B | Preparation method of graphene grafted POSS (polyhedral oligomeric silsesquioxane) synergetic flame-retardant polycarbonate composite material | 福建腾博新材料科技有限公司 | 2023-03-28 | — | — | CN | disclosed |
| CN-115850141-A | Intermediate compound and preparation method and application thereof | 科美博阳诊断技术(上海)有限公司 | 2023-03-28 | — | — | CN | disclosed |
| WO-1993023050-A1 | NEW DELTA-17 AND DELTA-20 OLEFINIC AND SATURATED 17β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONES AS 5α-REDUCTASE INHIBITORS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | disclosed |
| WO-1993023420-A1 | NEW 7β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONES AS 5α-REDUCTASE INHIBITORS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | disclosed |
| WO-1993023039-A1 | SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | disclosed |
| US-5233111-A | CATALYTIC PROCESS FOR SELECTIVE ALKYLATION OF AROMATIC HYDROCARBONS | MONSANTO COMPANY (US) | 1993-08-03 | — | — | US | disclosed |
| EP-0528096-A1 | Catalytic process for the selective alkylation of polycyclic aromatic compounds | MONSANTO EUROPE S.A./N.V. (BE) | 1993-02-24 | — | — | EP | disclosed |
| EP-0504541-A1 | Improved catalytic process for selective alkylation of aromatic hydrocarbons | MONSANTO EUROPE S.A./N.V. (BE) | 1992-09-23 | — | — | EP | disclosed |
| US-5100460-A | HERBICIDAL COMPOUNDS AND COMPOSITIONS CONTAINING THEM | RHONE-POULENC AGROCHIMIE (FR) | 1992-03-31 | — | — | US | disclosed |
| US-5101046-A | 3-CHLOROMETHYLSULFONYLMETHYL-4-SULFOMETHYL-PYRROLIDINIUM-BETAINES AND PROCESS FOR THEIR PREPARATION | BALLSCHUH DETLEF (DE) | 1992-03-31 | — | — | US | disclosed |
| US-4359334-A | N-HETEROCYCLIC AMIDE AND A 2-HALOETHYLSULFINATE | GAF CORPORATION (US) | 1982-11-16 | — | — | US | disclosed |