⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11402095 | 0.97 | — | — | |
| SCHEMBL6580621 | 0.91 | — | — | |
| SCHEMBL10168215 | 0.88 | HSD17B10 (0.32) | — | |
| SCHEMBL670117 | 0.80 | — | — | |
| SCHEMBL7116355 | 0.79 | HSD17B10 (0.44) | — | |
| SCHEMBL11399369 | 0.79 | — | — | |
| SCHEMBL17865645 | 0.78 | — | — | |
| SCHEMBL11076885 | 0.78 | — | — | |
| SCHEMBL11137343 | 0.78 | — | — | |
| SCHEMBL2627767 | 0.77 | SQLE (0.42) | — |
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 61 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110256638-A | A kind of preparation method containing the polycarboxylate water-reducer that anti-mud structure is complexed | 江门市科锐新材料有限公司 | 2019-09-20 | — | — | CN | claimed |
| CN-106008853-A | Preparation method of mud resisting and slump retaining type phosphate group containing polycarboxylate superplasticizer | 江苏中铁奥莱特新材料股份有限公司 | 2016-10-12 | — | — | CN | claimed |
| US-20240052109-A1 | POLYSILOXANE VINYLIC MONOMERS AND USES THEREOF | ALCON INC. (CH) | 2024-02-15 | — | — | US | disclosed |
| CN-110818523-B | Process for preparing 5-en-1-ynes and compounds derived therefrom | 信越化学工业株式会社 | 2023-05-02 | — | — | CN | disclosed |
| EP-3608302-B1 | PROCESS FOR PREPARING A 5-ALKEN-1-YNE COMPOUND, (6Z)-1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND, (2E,6Z)-2,6-NONADIENAL AND (2E)-CIS-6,7-EPOXY-2-NONENAL, AND 1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND | SHINETSU CHEMICAL CO (JP) | 2021-10-20 | — | — | EP | disclosed |
| US-10781146-B2 | Process for preparing a 5-alken-1-yne compound, (6Z)-1,1-dialkoxy-6-nonen-2-yne compound, (2E,6Z)-2,6-nonadienal and (2E)-cis-6,7-epoxy-2-nonenal, and 1,1-dialkoxy-6-nonen-2-yne compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-09-22 | — | — | US | disclosed |
| CN-110818523-A | Process for preparing 5-en-1-ynes and their derivatives and 1, 1-dialkoxy-6-nonene-2-ynes | 信越化学工业株式会社 | 2020-02-21 | — | — | CN | disclosed |
| US-20200048161-A1 | PROCESS FOR PREPARING A 5-ALKEN-1-YNE COMPOUND, (6Z)-1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND, (2E,6Z)-2,6-NONADIENAL AND (2E)-CIS-6,7-EPOXY-2-NONENAL, AND 1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2020-02-13 | — | — | US | disclosed |
| EP-3608302-A1 | PROCESS FOR PREPARING A 5-ALKEN-1-YNE COMPOUND, (6Z)-1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND, (2E,6Z)-2,6-NONADIENAL AND (2E)-CIS-6,7-EPOXY-2-NONENAL, AND 1,1-DIALKOXY-6-NONEN-2-YNE COMPOUND | Shin-Etsu Chemical Co., Ltd. (JP) | 2020-02-12 | — | — | EP | disclosed |
| CN-110256638-A | A kind of preparation method containing the polycarboxylate water-reducer that anti-mud structure is complexed | 江门市科锐新材料有限公司 | 2019-09-20 | — | — | CN | disclosed |
| US-9670244-B2 | Oxysterol compounds and the hedgehog pathway | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2017-06-06 | — | — | US | disclosed |
| WO-2002002057-A1 | DENTAL MATERIAL CONTAINING PHOSPHONIC ACIDS | ERNST MÜHLBAUER GMBH & CO. KG (DE) | 2002-01-10 | — | — | WO | disclosed |
| EP-1169996-A1 | Phosphonic acid containing dental material | ERNST MÜHLBAUER KG (DE) | 2002-01-09 | — | — | EP | disclosed |
| US-5637771-A | Compound useful for lowering cholesterol | HOFFMANN-LA ROCHE INC. (US) | 1997-06-10 | — | — | US | disclosed |
| US-5574071-A | ADMINISTERING PHENYLALKYLAMINO KETONES | HOFFMANN-LA ROCHE INC. (US) | 1996-11-12 | — | — | US | disclosed |
| US-5495048-A | ANTICHOLESTEROL AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1996-02-27 | — | — | US | disclosed |
| CN-1103781-A | Use of phenalkylamines | HOFFMANN LA ROCHE (CH) | 1995-06-21 | — | — | CN | disclosed |
| EP-0636367-A1 | Use of phenylalkylamines for producing cholesterol lowering agents | F. HOFFMANN-LA ROCHE AG (CH) | 1995-02-01 | — | — | EP | disclosed |
| US-4264518-A | INTERMEDIATE FOR MAKING INSECT PHEROMONE FOR CONTROLLING SCALE | ZOECON CORPORATION (US) | 1981-04-28 | — | — | US | disclosed |
| US-4223012-A | 3,7-DIMETHYL-2,7-OCTADIEN-1-YL PROPIONATE | ZOECON CORPORATION (US) | 1980-09-16 | — | — | US | disclosed |