⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20767763 | 0.97 | — | — | |
| SCHEMBL17965700 | 0.91 | — | — | |
| SCHEMBL17965825 | 0.88 | — | — | |
| SCHEMBL17965701 | 0.88 | ALDH1A1 (0.35) | — | |
| SCHEMBL9719768 | 0.86 | ALDH1A1 (0.33) | — | |
| SCHEMBL11673918 | 0.79 | TSHR (0.46) | — | |
| SCHEMBL6734294 | 0.73 | TSHR (0.40) | — | |
| SCHEMBL10743072 | 0.73 | — | — | |
| SCHEMBL11271214 | 0.71 | — | — | |
| SCHEMBL10489497 | 0.71 | — | — |
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 19 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106167459-A | A kind of new method synthesizing thiazolinyl sulfocyanic ester derivant | 华南理工大学 | 2016-11-30 | — | — | CN | claimed |
| EP-0084860-A1 | A novel compound 5-chloro-1-bromo-1-pentyne and a method for the preparation thereof | Shin-Etsu Chemical Co., Ltd. (JP) | 1983-08-03 | — | — | EP | claimed |
| US-12479786-B2 | 11-halo-1,1-dialkoxy-7-undecene compound and processes for preparing a 11,11-dialkoxy-4-undecenyltriarylphosphonium halide compound, a trienal compound, and a dienal compound | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2025-11-25 | — | — | US | disclosed |
| US-20240182394-A1 | PROCESS FOR PREPARING (Z)-7-TETRADECEN-2-ONE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2024-06-06 | — | — | US | disclosed |
| EP-4368604-A1 | PROCESS FOR PREPARING (Z)-7-TETRADECEN-2-ONE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2024-05-15 | — | — | EP | disclosed |
| CN-118005491-A | Method for preparing (Z) -7-tetradecene-2-ketone | 信越化学工业株式会社 | 2024-05-10 | — | — | CN | disclosed |
| EP-4063376-B1 | 11-HALO-1,1-DIALKOXY-7-UNDECENE COMPOUND AND PROCESSES FOR PREPARING A 11,11-DIALKOXY-4-UNDECENYLTRIARYLPHOSPHONIUM HALIDE COMPOUND, A TRIENAL COMPOUND, AND A DIENAL COMPOUND | SHINETSU CHEMICAL CO (JP) | 2023-11-22 | — | — | EP | disclosed |
| US-20220315513-A1 | 11-HALO-1,1-DIALKOXY-7-UNDECENE COMPOUND AND PROCESSES FOR PREPARING A 11,11-DIALKOXY-4-UNDECENYLTRIARYLPHOSPHONIUM HALIDE COMPOUND, A TRIENAL COMPOUND, AND A DIENAL COMPOUND | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2022-10-06 | — | — | US | disclosed |
| EP-4063376-A1 | 11-HALO-1,1-DIALKOXY-7-UNDECENE COMPOUND AND PROCESSES FOR PREPARING A 11,11-DIALKOXY-4-UNDECENYLTRIARYLPHOSPHONIUM HALIDE COMPOUND, A TRIENAL COMPOUND, AND A DIENAL COMPOUND | Shin-Etsu Chemical Co., Ltd. (JP) | 2022-09-28 | — | — | EP | disclosed |
| CN-115109088-A | Substituted undecene compounds and substituted undecenyltriarylphosphonium halides and methods of making compounds and mixtures therefrom | 信越化学工业株式会社 | 2022-09-27 | — | — | CN | disclosed |
| CN-105859529-B | Method for producing asymmetric conjugated diyne compound and method for producing Z, Z-conjugated diene compound using the same | 信越化学工业株式会社 | 2020-10-16 | — | — | CN | disclosed |
| EP-3053906-B1 | METHOD FOR PRODUCING ASYMMETRIC CONJUGATED DIYNE COMPOUND AND METHOD FOR PRODUCING Z,Z-CONJUGATED DIENE COMPOUND USING THE SAME | SHINETSU CHEMICAL CO (JP) | 2017-12-27 | — | — | EP | disclosed |
| US-9845304-B2 | Method for producing asymmetric conjugated diyne compound and method for producing Z,Z-conjugated diene compound using the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2017-12-19 | — | — | US | disclosed |
| CN-106167459-A | A kind of new method synthesizing thiazolinyl sulfocyanic ester derivant | 华南理工大学 | 2016-11-30 | — | — | CN | disclosed |
| US-20160229829-A1 | Method for Producing Asymmetric Conjugated Diyne Compound and Method for Producing Z,Z-Conjugated Diene Compound Using the Same | SHIN-ETSU CHEMICAL CO., LTD (JP) | 2016-08-11 | — | — | US | disclosed |
| EP-3053906-A1 | METHOD FOR PRODUCING ASYMMETRIC CONJUGATED DIYNE COMPOUND AND METHOD FOR PRODUCING Z,Z-CONJUGATED DIENE COMPOUND USING THE SAME | Shin-Etsu Chemical Co., Ltd. (JP) | 2016-08-10 | — | — | EP | disclosed |
| EP-0084860-A1 | A novel compound 5-chloro-1-bromo-1-pentyne and a method for the preparation thereof | Shin-Etsu Chemical Co., Ltd. (JP) | 1983-08-03 | — | — | EP | disclosed |
| EP-0084860-A1 | A novel compound 5-chloro-1-bromo-1-pentyne and a method for the preparation thereof | Shin-Etsu Chemical Co., Ltd. (JP) | 1983-08-03 | — | — | EP | disclosed |
| EP-0084860-A1 | A novel compound 5-chloro-1-bromo-1-pentyne and a method for the preparation thereof | Shin-Etsu Chemical Co., Ltd. (JP) | 1983-08-03 | — | — | EP | disclosed |