⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL457172 | 1.00 | — | — | |
| SCHEMBL7147272 | 0.90 | MAPT (0.50) | — | |
| SCHEMBL4937612 | 0.90 | MAPT (0.50) | — | |
| SCHEMBL6537162 | 0.90 | MAPT (0.50) | — | |
| SCHEMBL749955 | 0.89 | — | — | |
| SCHEMBL17316227 | 0.89 | — | — | |
| SCHEMBL28569086 | 0.86 | — | — | |
| Nonanal SCHEMBL11055718 | 0.83 | TSHR (0.64) | — | |
| 2-Pentanol SCHEMBL6354152 | 0.81 | TSHR (0.61) | — | |
| Glutaral SCHEMBL5421846 | 0.80 | HIF1A (0.62) | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1021392-B1 | PROCESSES FOR PRODUCING HYDROXYALDEHYDES | UNION CARBIDE CHEM PLASTIC (US) | 2002-12-18 | — | — | EP | claimed |
| CN-110799608-B | Aqueous dispersion, coating composition formed from the aqueous dispersion and multilayer coating | PPG工业俄亥俄公司 | 2021-09-24 | — | — | CN | disclosed |
| CN-108440535-B | Metal fullerene nitroxide free radical derivative and preparation method and application thereof | 中国科学院化学研究所 | 2020-11-06 | — | — | CN | disclosed |
| CN-110799608-A | Aqueous dispersion, coating composition formed from the aqueous dispersion and multilayer coating | PPG工业俄亥俄公司 | 2020-02-14 | — | — | CN | disclosed |
| US-9873836-B2 | Process for converting biomass to aromatic hydrocarbons | VIRENT, INC. (US) | 2018-01-23 | — | — | US | disclosed |
| EP-2645103-B1 | GLYCOPEPTIDE ARRAY | UNIV HOKKAIDO NAT UNIV CORP (JP) | 2016-03-23 | — | — | EP | disclosed |
| US-20140349361-A1 | Process for Converting Biomass to Aromatic Hydrocarbons | VIRENT, INC. (US) | 2014-11-27 | — | — | US | disclosed |
| US-20130316932-A1 | GLYCOPEPTIDE ARRAY | SUMITOMO BAKELITE CO., LTD. (JP) | 2013-11-28 | — | — | US | disclosed |
| EP-2645103-A1 | GLYCOPEPTIDE ARRAY | National University Corporation Hokkaido University (JP) | 2013-10-02 | — | — | EP | disclosed |
| EP-2430024-A1 | [1,2,4]TRIAZOLO [4,3-B]PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR | AstraZeneca AB (SE) | 2012-03-21 | — | — | EP | disclosed |
| EP-1142858-A1 | PROCESS FOR PRODUCING ALIPHATIC ALDEHYDIC ACID AND/OR ALIPHATIC DICARBOXYLIC ACID AND CATALYST FOR THE PRODUCTION | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-10-10 | — | — | EP | disclosed |
| EP-0714897-B1 | FUSED HETEROAROMATIC CYCLOPENTENE DERIVATIVE HAVING ENDOTHELIN-ANTAGONIST ACTIVITY | BANYU PHARMA CO LTD (JP) | 2001-02-14 | — | — | EP | disclosed |
| EP-0906108-A4 | METHOD OF TREATING HEART FAILURE WITH ENDOTHELIN ANTAGONISTS | BANYU PHARMA CO LTD (JP) | 2000-12-06 | — | — | EP | disclosed |
| US-6087360-A | TREATING PATIENTS WITH ENDOTHELIN RELATED DISORDERS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2000-07-11 | — | — | US | disclosed |
| EP-0906108-A1 | METHOD OF TREATING HEART FAILURE WITH ENDOTHELIN ANTAGONISTS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1999-04-07 | — | — | EP | disclosed |
| US-5834483-A | Method of treating heart failure with endothelin antagonists | MERCK & CO., INC. (US) | 1998-11-10 | — | — | US | disclosed |
| US-5714479-A | TREATMENT OF HYPERTENSION, ACUTE RENAL FAILURE, ANGINA PECTORIS, ARTERIOSCLEROSIS, ASTHMA, GASTRIC ULCER AND SIMILAR AILMENTS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-02-03 | — | — | US | disclosed |
| EP-0714897-A1 | FUSED HETEROAROMATIC CYCLOPENTENE DERIVATIVE HAVING ENDOTHELIN-ANTAGONIST ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-06-05 | — | — | EP | disclosed |
| US-5049308-A | Electrooptics | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1991-09-17 | — | — | US | disclosed |
| US-4886623-A | Ferroelectric smectic liquid crystal compound and composition containing the same | TAKASAGO INTERNATIONAL CORPORATION (JP) | 1989-12-12 | — | — | US | disclosed |