⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9618300 | 0.81 | CES2 (0.32) | — | |
| SCHEMBL11630550 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL1583583 | 0.79 | — | — | |
| SCHEMBL16139838 | 0.78 | CES2 (0.54) | — | |
| SCHEMBL1144196 | 0.77 | — | — | |
| SCHEMBL28429573 | 0.77 | CES2 (0.30) | — | |
| SCHEMBL1681615 | 0.77 | CYP4F2 (0.44) | — | |
| SCHEMBL1097334 | 0.77 | — | — | |
| SCHEMBL2880832 | 0.77 | CES2 (0.53) | — | |
| SCHEMBL6350851 | 0.76 | — | — |
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 86 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021240331-A1 | PROCESS FOR THE PREPARATION OF 3,5-DICHLORO-2,2,2-TRIFLUOROACETOPHENONE | HIKAL LIMITED (IN) | 2021-12-02 | — | — | WO | claimed |
| CN-109790121-A | It is used to prepare the method and intermediate of BTK inhibitor | 詹森药业有限公司 | 2019-05-21 | — | — | CN | claimed |
| WO-2015118515-A1 | AN IMPROVED PROCESS FOR THE PREPARATION OF A NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITOR | DISCOVERY INTERMEDIATES PRIVATE LIMITED (IN) | 2015-08-13 | — | — | WO | claimed |
| WO-2013186792-A2 | PROCESS FOR THE PREPARATION OF (5-METHYL-2-OXO-L,3-DIOXOI-4-VL)METHVL 2- ETHOXV-L-{[2'-(5-OXO-4,5-DIHVDRO-L,2,4-OXADIAZOL-3-VL)BIPHENYI-4-VL]METHYL}- LH-BENZIMIDAZOLE-7-CARBOXYIATE AND ITS SALTS | MSN LABORATORIES LIMITED (IN) | 2013-12-19 | — | — | WO | claimed |
| CN-117384010-A | Continuous preparation method of 2, 2-trifluoroethanol | 浙江巨化技术中心有限公司 | 2024-01-12 | — | — | CN | disclosed |
| CN-115636723-B | Preparation method of trifluoroethanol | 浙江巨化技术中心有限公司 | 2023-12-19 | — | — | CN | disclosed |
| EP-4021441-A1 | MEMBRANE-ACTIVE ANTI-BACTERIAL COMPOUNDS AND USES THEREOF | Trustees of Dartmouth College (US) | 2022-07-06 | — | — | EP | disclosed |
| EP-3927699-A1 | MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN | Nalo Therapeutics (US) | 2021-12-29 | — | — | EP | disclosed |
| US-20210369710-A1 | MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN | NALO THERAPEUTICS (US) | 2021-12-02 | — | — | US | disclosed |
| WO-2021042046-A1 | MEMBRANE-ACTIVE ANTI-BACTERIAL COMPOUNDS AND USES THEREOF | TRUSTEES OF DARTMOUTH COLLEGE (US) | 2021-03-04 | — | — | WO | disclosed |
| US-10808246-B2 | Oligonucleotide-ligand conjugates and process for their preparation | ALNYLAM PHARMACEUTICALS, INC. (US) | 2020-10-20 | — | — | US | disclosed |
| EP-3548469-B1 | METHOD FOR THE MANUFACTURE OF EFAVIRENZ | UNIV NELSON MANDELA METROPOLITAN (ZA) | 2020-08-26 | — | — | EP | disclosed |
| EP-0679645-A1 | Pharmacologically active CNS pyridmidin compounds | THE WELLCOME FOUNDATION LIMITED (GB) | 1995-11-02 | — | — | EP | disclosed |
| WO-1994029255-A1 | AROMATIC ACETYLCHOLINESTERASE INHIBITORS | MERRELL PHARMACEUTICALS INC. (US) | 1994-12-22 | — | — | WO | disclosed |
| EP-0627400-A1 | Aromatic acetylcholinesterase inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-12-07 | — | — | EP | disclosed |
| EP-0459819-A2 | Pharmacologically active CNS compound | THE WELLCOME FOUNDATION LIMITED (GB) | 1991-12-04 | — | — | EP | disclosed |
| EP-0245230-A1 | Substituted 2,6-substituted pyridine compounds | Monsanto Company (US) | 1987-11-11 | — | — | EP | disclosed |
| US-4097599-A | PESTICIDES | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) | 1978-06-27 | — | — | US | disclosed |
| US-4038405-A | MITICIDES | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) | 1977-07-26 | — | — | US | disclosed |
| US-3960736-A | POLYSACCHARIDE THICKENING AGENT | THE DOW CHEMICAL COMPANY (US) | 1976-06-01 | — | — | US | disclosed |