⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7643702 | 0.90 | FAAH (0.31) | — | |
| SCHEMBL20337956 | 0.85 | FAAH (0.36) | — | |
| SCHEMBL20337844 | 0.83 | TSHR (0.36) | — | |
| SCHEMBL8643000 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL6062402 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL20337904 | 0.81 | TSHR (0.39) | — | |
| SCHEMBL10510441 | 0.77 | FAAH (0.34) | — | |
| SCHEMBL14128628 | 0.76 | — | — | |
| SCHEMBL985970 | 0.74 | — | — | |
| SCHEMBL6907900 | 0.73 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10941092-B2 | Hydroformylation process for producing 1,6-hexanediol derivatives | BASF SE | 2021-03-09 | — | — | US | disclosed |
| US-10941092-B2 | Hydroformylation process for producing 1,6-hexanediol derivatives | BASF SE | 2021-03-09 | — | — | US | disclosed |
| US-20200172458-A1 | HYDROFORMYLATION PROCESS FOR PRODUCING 1,6-HEXANEDIOL DERIVATIVES | BASF SE (DE) | 2020-06-04 | — | — | US | disclosed |
| US-20200172458-A1 | HYDROFORMYLATION PROCESS FOR PRODUCING 1,6-HEXANEDIOL DERIVATIVES | BASF SE (DE) | 2020-06-04 | — | — | US | disclosed |
| CN-110621663-A | Hydroformylation process for the preparation of 1, 6-hexanediol derivatives | 巴斯夫欧洲公司 | 2019-12-27 | — | — | CN | disclosed |
| EP-3233820-A1 | NOVEL ACETALS OF 1-(3,3-DIMETHYLCYCLOHEX-1-ENYL) ETHANONE, METHOD FOR THE PRODUCTION THEREOF AND USE OF SAME IN PERFUMERY | V. Mane Fils (FR) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016097569-A1 | NOVEL ACETALS OF 1-(3,3-DIMETHYLCYCLOHEX-1-ENYL) ETHANONE, METHOD FOR THE PRODUCTION THEREOF AND USE OF SAME IN PERFUMERY | V. MANE FILS (FR) | 2016-06-23 | — | — | WO | disclosed |
| US-9133218-B2 | Pesticidally active pyridyl- and pyrimidyl-substituted thiazole derivatives | SYNGENTA PARTICIPATIONS AG (CH) | 2015-09-15 | — | — | US | disclosed |
| US-20150141423-A1 | PESTICIDALLY ACTIVE PYRIDYL- AND PYRIMIDYL- SUBSTITUTED THIAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2015-05-21 | — | — | US | disclosed |