⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL79201 | 0.76 | MAOA (0.47) | — | |
| SCHEMBL3490675 | 0.76 | — | — | |
| SCHEMBL194206 | 0.76 | — | — | |
| SCHEMBL1777624 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL29964022 | 0.74 | — | — | |
| SCHEMBL6284681 | 0.74 | MAOA (0.45) | — | |
| Bromide SCHEMBL29027396 | 0.74 | MAOA (0.45) | — | |
| SCHEMBL30532125 | 0.74 | MAOA (0.45) | — | |
| Bromide SCHEMBL29027395 | 0.74 | MAOA (0.45) | — | |
| Benzene SCHEMBL28241649 | 0.74 | MAOA (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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2117709-A2 | HYBRID MATERIAL, AND METHOD FOR THE PRODUCTION THEREOF | UNIVERSITE PIERRE ET MARIE CURIE (FR) | 2009-11-18 | — | — | EP | claimed |
| WO-2008129151-A2 | HYBRID MATERIAL, AND METHOD FOR THE PRODUCTION THEREOF | UNIVERSITE PIERRE ET MARIE CURIE (FR) | 2008-10-30 | — | — | WO | claimed |
| WO-2024036317-A1 | METHODS FOR LABELING N-TERMINAL GLYCINE FOR PROTEOMICS | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2024-02-15 | — | — | WO | disclosed |
| CN-115023139-A | PPO formulations containing ether sulfates | 巴斯夫欧洲公司 | 2022-09-06 | — | — | CN | disclosed |
| WO-2022093792-A1 | ELECTROLYTE ADDITIVES CONTAINING ONE, TWO, OR MORE TRIPLE-BONDED MOIETIES FOR SILICON ANODE-BASED BATTERIES | ENEVATE CORPORATION (US) | 2022-05-05 | — | — | WO | disclosed |
| CN-107846889-B | Herbicidal composition comprising cycloheptane and pyroxasulfone | 巴斯夫农业公司 | 2020-12-08 | — | — | CN | disclosed |
| CN-104761544-B | The selective depressant of the important mutant of clinic of EGFR tyrosine kinase | 北京轩义医药科技有限公司 | 2019-03-15 | — | — | CN | disclosed |
| US-9376402-B2 | 1, 2, 4-triazole derivatives and their anti-microbial activity | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2016-06-28 | — | — | US | disclosed |
| US-20150073026-A1 | 1, 2, 4-TRIAZOLE DERIVATIVES AND THEIR ANTI-MICROBIAL ACTIVITY | COUNCIL SCIENT IND RES (IN) | 2015-03-12 | — | — | US | disclosed |
| US-8865910-B2 | 1, 2, 4-triazole derivatives and their anti mycobacterial activity | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2014-10-21 | — | — | US | disclosed |
| US-20130060045-A1 | 1, 2, 4-TRIAZOLE DERIVATIVES AND THEIR ANTI MYCOBACTERIAL ACTIVITY | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2013-03-07 | — | — | US | disclosed |
| WO-2011111077-A1 | 1, 2, 4-TRIAZOLE DERIVATIVES AND THEIR ANTI MYCOBACTERIAL ACTIVITY | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2011-09-15 | — | — | WO | disclosed |
| EP-2117709-A2 | HYBRID MATERIAL, AND METHOD FOR THE PRODUCTION THEREOF | UNIVERSITE PIERRE ET MARIE CURIE (FR) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008129151-A2 | HYBRID MATERIAL, AND METHOD FOR THE PRODUCTION THEREOF | UNIVERSITE PIERRE ET MARIE CURIE (FR) | 2008-10-30 | — | — | WO | disclosed |
| CN-1309302-C | Herbicide and safener combination | BAYER CROP SCIENCE GMBH (DE) | 2007-04-11 | — | — | CN | disclosed |
| US-3832466-A | 3-AZOLYLPROPYNE FUNGICIDAL AGENTS | BAYER AG | 1974-08-27 | — | — | US | disclosed |