⚠ 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11267252 | 0.96 | — | — | |
| Bromide SCHEMBL11267245 | 0.96 | — | — | |
| SCHEMBL15904592 | 0.72 | — | — | |
| SCHEMBL31753913 | 0.72 | — | — | |
| SCHEMBL16706957 | 0.72 | — | — | |
| SCHEMBL25094981 | 0.70 | — | — | |
| SCHEMBL4730315 | 0.70 | — | — | |
| SCHEMBL7399 | 0.70 | — | — | |
| SCHEMBL803810 | 0.70 | ALDH1A1 (0.60) | — | |
| SCHEMBL13400316 | 0.67 | ALDH1A1 (0.56) | — |
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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106431825-A | Synthesis method of pancuronium bromide drug intermediate 2-bromopropene | 厦门市凯尔利信息科技有限公司 | 2017-02-22 | — | — | CN | claimed |
| CN-105566056-A | Synthetic method of pancuronium bromide pharmaceutical intermediate 2-bromopropylene | CHENGDU QIANYE LONGHUA PETROLEUM ENG TECH CONSULTING CO LTD | 2016-05-11 | — | — | CN | claimed |
| US-4507500-A | REACTING A MERCAPTOTHIAZOLINE WITH A HALOGENOETHYLAMINE HYDROHALIDE | MITSUI TOATSU CHEMICALS, INC. (JP) | 1985-03-26 | — | — | US | claimed |
| EP-0044203-B1 | PROCESS FOR PRODUCING 2-MERCAPTOETHYLAMINE HYDROHALIDES | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-06-20 | — | — | EP | claimed |
| EP-0044203-A1 | Process for producing 2-mercaptoethylamine hydrohalides | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1982-01-20 | — | — | EP | claimed |
| CN-115181092-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-113710664-B | JAK1 selective kinase inhibitors | 迪哲(江苏)医药股份有限公司 | 2024-01-26 | — | — | CN | disclosed |
| US-20240016152-A1 | ACTIVE COMPOUND COMBINATIONS | BAYER AKTIENGESELLSCHAFT (DE) | 2024-01-18 | — | — | US | disclosed |
| US-20230135068-A1 | PYRAZINE COMPOUNDS AND USES THEREOF | DIZAL JIANGSU PHARMACEUTICAL CO LTD (CN) | 2023-05-04 | — | — | US | disclosed |
| US-11629147-B2 | Triazolo-pyrimidine compounds and uses thereof | DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) | 2023-04-18 | — | — | US | disclosed |
| US-11571420-B2 | Pyrazine compounds and uses thereof | DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) | 2023-02-07 | — | — | US | disclosed |
| CN-112279852-B | Triazolo-pyrimidine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2023-01-17 | — | — | CN | disclosed |
| CN-105566056-A | Synthetic method of pancuronium bromide pharmaceutical intermediate 2-bromopropylene | CHENGDU QIANYE LONGHUA PETROLEUM ENG TECH CONSULTING CO LTD | 2016-05-11 | — | — | CN | disclosed |
| CN-105566056-A | Synthetic method of pancuronium bromide pharmaceutical intermediate 2-bromopropylene | CHENGDU QIANYE LONGHUA PETROLEUM ENG TECH CONSULTING CO LTD | 2016-05-11 | — | — | CN | disclosed |
| CN-1169863-C | Superbranched polyquaternary ammonium salt and its preparation method | 清华大学 | 2004-10-06 | — | — | CN | disclosed |
| EP-1147076-B1 | ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES | OKANO TERUO PROF (JP) | 2004-03-31 | — | — | EP | disclosed |
| CN-1394897-A | Superbranched polyquaternary ammonium salt and its preparation method | UNIV TSINGHUA (CN) | 2003-02-05 | — | — | CN | disclosed |
| US-6495645-B1 | INCORPORATING MANY SIDE FUNCTIONAL GROUPS WHILE MAINTAINING SENSITIVE TEMPERATURE RESPONSE | Okano, Terou (JP) | 2002-12-17 | — | — | US | disclosed |
| EP-1147076-A1 | ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES | Amersham Pharmacia Biotech K.K. (JP) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000043355-A1 | ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES | AMERSHAM PHARMACIA BIOTECH K.K. (JP) | 2000-07-27 | — | — | WO | disclosed |