⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL981125 | 0.84 | TRPA1 (0.42) | — | |
| SCHEMBL8988354 | 0.78 | TRPA1 (0.37) | — | |
| SCHEMBL931699 | 0.77 | — | — | |
| SCHEMBL131361 | 0.75 | ALDH1A1 (0.67) | — | |
| SCHEMBL6576818 | 0.73 | GFER (0.40) | — | |
| SCHEMBL320687 | 0.73 | CALM1 (0.44) | — | |
| SCHEMBL263456 | 0.73 | TDP1 (0.39) | — | |
| Bromide SCHEMBL29980639 | 0.72 | ALDH1A1 (0.62) | — | |
| SCHEMBL3391042 | 0.71 | — | — | |
| SCHEMBL1176609 | 0.71 | ALDH1A1 (0.45) | — |
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 635 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118206417-A | Cobalt catalytic dehalogenation deuteration method | 中国科学院大连化学物理研究所 | 2024-06-18 | — | — | CN | claimed |
| CN-117486781-A | Method for synthesizing 6, 6-dimethyl-3-azabicyclo [3.1.0] hexane | 风火轮(上海)生物科技有限公司 | 2024-02-02 | — | — | CN | claimed |
| CN-113620820-B | Functionalized magnetic ionic liquid and preparation method and application thereof | 辽宁大学 | 2023-12-29 | — | — | CN | claimed |
| CN-117024458-A | Fluorescent probe for efficiently and rapidly detecting ClO-and slowly detecting H2O2 and preparation method thereof | 菏泽学院 | 2023-11-10 | — | — | CN | claimed |
| US-20230322816-A1 | PYRAZOLE BORONIC ACID COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USES THEREOF | BEIJING SONGRUN PHARMACEUTICAL TECHNOLOGY CO., LTD. (CN) | 2023-10-12 | — | — | US | claimed |
| CN-116535311-A | Novel synthesis method of Carbonic acid | 风火轮(上海)生物科技有限公司 | 2023-08-04 | — | — | CN | claimed |
| CN-114075227-B | Pyrazole boric acid compound, pharmaceutical composition containing pyrazole boric acid compound and application of pyrazole boric acid compound and pharmaceutical composition | 北京嵩润医药科技有限责任公司 | 2023-07-04 | — | — | CN | claimed |
| EP-4201941-A1 | PYRAZOLE BORONIC ACID COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USES THEREOF | Beijing Songrun Pharmaceutical Technology Co., Ltd. (CN) | 2023-06-28 | — | — | EP | claimed |
| CN-115403483-A | CA-4 derivative containing stilbene or benzophenone skeleton, pharmaceutical composition, preparation method and application thereof | 河南省儿童医院郑州儿童医院 | 2022-11-29 | — | — | CN | claimed |
| CN-115232073-B | Preparation and application of 1H-naphthalene [2,3-d ] imidazole-based light-responsive organic long afterglow material | 南京邮电大学 | 2022-11-22 | — | — | CN | claimed |
| EP-1337520-A1 | SUBSTITUTED 5-ARYL AND 5-HETEROARYL-2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE DERIVATIVES AS UV ABSORBERS | Ciba SC Holding AG (CH) | 2003-08-27 | — | — | EP | claimed |
| WO-2003010206-A1 | POLYMERS AND THEIR SYNTHESIS | UNILEVER PLC (GB) | 2003-02-06 | — | — | WO | claimed |
| CN-1393131-A | Antifungal triazole compounds | MILITARY MEDICAL UNIV NO 2 P L (CN) | 2003-01-29 | — | — | CN | claimed |
| CN-1089749-C | Pesticidal hydrazide derivatives | UNIROYAL CHEMICAL CO LTD (US) | 2002-08-28 | — | — | CN | claimed |
| WO-2002042281-A1 | SUBSTITUTED 5-ARYL AND 5-HETEROARYL-2-(2-HYDROXYPHENYL)-2H-BENZOTRIAZOLE DERIVATIVES AS UV ABSORBERS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2002-05-30 | — | — | WO | claimed |
| CN-1213365-A | Pesticidal hydrazide derivatives | UNIROYAL CHEMICAL CO LTD (US) | 1999-04-07 | — | — | CN | claimed |
| US-4692515-A | BACTERICIDE, ANTICONVULSANT, ANTIHYPOXIA, ANTIPARKINSON, ANTICHOLINERGICS | PENNWALT CORPORATION (US) | 1987-09-08 | — | — | US | claimed |
| EP-0003771-B1 | CARBOSTYRILE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Dr. Karl Thomae GmbH (DE) | 1982-10-20 | — | — | EP | claimed |
| US-4329347-A | Cardiotonic and antithrombotic sulfur-containing derivatives of carbostyril | BOEHRINGER INGELHEIM GMBH (DE) | 1982-05-11 | — | — | US | claimed |
| US-3956307-A | FUNGICIDES | SCHERING AKTIENGESELLSCHAFT (DT) | 1976-05-11 | — | — | US | claimed |