⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL10976746 | 0.78 | — | — | |
| SCHEMBL7766444 | 0.71 | — | — | |
| SCHEMBL3611141 | 0.67 | — | — | |
| SCHEMBL1958091 | 0.43 | — | — | |
| SCHEMBL60586 | 0.43 | — | — | |
| SCHEMBL25669 | 0.43 | ALDH1A1 (0.36) | — | |
| SCHEMBL134032 | 0.37 | — | — | |
| SCHEMBL27748 | 0.37 | — | — | |
| SCHEMBL2936221 | 0.37 | — | — | |
| SCHEMBL3668 | 0.37 | — | — |
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
Appears in 5495 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122010689-A | Preparation method of cycloparaffin | 浙江清华长三角研究院 | 2026-05-12 | — | — | CN | claimed |
| WO-2025242747-A1 | MULTI -COMPONENT FORMULATIONS OF ORGANOMETALLIC REAGENTS | MERCK PATENT GMBH (DE) | 2025-11-27 | — | — | WO | claimed |
| CN-118598781-B | Preparation method of key intermediate of montelukast sodium | 迪嘉药业集团股份有限公司 | 2025-06-10 | — | — | CN | claimed |
| CN-120039829-A | Method for purifying hydrogen chloride in fluorine-containing hydrogen chloride tail gas | 万华化学集团股份有限公司 | 2025-05-27 | — | — | CN | claimed |
| CN-119751257-A | Synthesis method of 2- (5-bromo-2-fluorophenyl) -2-cyclopropylacetic acid methyl ester and analogue thereof | 韶远科技（上海)有限公司 | 2025-04-04 | — | — | CN | claimed |
| CN-118930535-A | Synthesis method of 5-bromo-3-cyclopropyl-1H-pyrrolo [2,3-b ] pyridine | 上海毕得医药科技股份有限公司 | 2024-11-12 | — | — | CN | claimed |
| CN-118598781-A | Preparation method of key intermediate of montelukast sodium | 迪嘉药业集团股份有限公司 | 2024-09-06 | — | — | CN | claimed |
| CN-118324846-A | Bufogargarizin A preparation method | 南方科技大学 | 2024-07-12 | — | — | CN | claimed |
| CN-115784857-B | 4-Fluorophenyl cyclopropyl ketone-14C and preparation method thereof | 长沙贝塔医药科技有限公司 | 2024-05-24 | — | — | CN | claimed |
| CN-117024354-B | Preparation method of Rui Mi Buti Ni | 天津凯莱英制药有限公司 | 2023-12-08 | — | — | CN | claimed |
| US-20100075952-A1 | PYRROLO-NITROGENOUS HETEROCYCLIC DERIVATIES,THE PREPARATION AND THE PHARMCETICAL USE THEEOF | SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD (CN) | 2010-03-25 | — | — | US | claimed |
| EP-2157093-A1 | PYRROLO-NITROGENOUS HETEROCYCLIC DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF | Shanghai Hengrui Pharmaceutical Co. Ltd. (CN) | 2010-02-24 | — | — | EP | claimed |
| WO-2009132240-A2 | IN SITU OLEFIN POLYMERIZATION CATALYST SYSTEM | PROMERUS LLC (US) | 2009-10-29 | — | — | WO | claimed |
| US-20090270247-A1 | IN SITU OLEFIN POLYMERIZATION CATALYST SYSTEM | PROMERUS LLC (US) | 2009-10-29 | — | — | US | claimed |
| US-7273948-B2 | Process of preparing esters and ethers of probucol and derivatives thereof | ATHEROGENICS, INC. (US) | 2007-09-25 | — | — | US | claimed |
| EP-1594824-A4 | PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF | ATHEROGENICS INC (US) | 2007-04-04 | — | — | EP | claimed |
| EP-1594824-A2 | PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF | Atherogenics, Inc. (US) | 2005-11-16 | — | — | EP | claimed |
| US-20040204485-A1 | Process of preparing esters and ethers of probucol and derivatives thereof | CRABTREE ACQUISITION CO, LLC | 2004-10-14 | — | — | US | claimed |
| WO-2004062622-A2 | PROCESS OF PREPARING ESTERS AND ETHERS OF PROBUCOL AND DERIVATIVES THEREOF | ATHEROGENICS, INC. (US) | 2004-07-29 | — | — | WO | claimed |
| US-6479661-B1 | Method for symmetrically and asymmetrically disubstituting carboxylic acid amides with organotitanates and grignard reagents | MERCK PATENT GESELLSCHAFT (DE) | 2002-11-12 | — | — | US | claimed |