⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1032836 | 1.00 | — | — | |
| SCHEMBL1031587 | 1.00 | — | — | |
| SCHEMBL28499159 | 0.78 | — | — | |
| SCHEMBL13263355 | 0.72 | — | — | |
| SCHEMBL6439082 | 0.72 | — | — | |
| SCHEMBL10522453 | 0.72 | TSHR (0.34) | — | |
| 2-Methylbutanal SCHEMBL3485198 | 0.69 | — | — | |
| SCHEMBL5406350 | 0.69 | — | — | |
| SCHEMBL170891 | 0.69 | — | — | |
| 2-Methylbutanal SCHEMBL43412 | 0.69 | — | — |
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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108602820-A | Hetero-1, 5,6, 7-tetrahydro-4H-indol-4-ones | 拜耳制药股份公司 | 2018-09-28 | — | — | CN | claimed |
| CN-107922389-A | 3 amino, 1,5,6,7 tetrahydrochysene 4H indoles, 4 ketone | 拜耳制药股份公司 | 2018-04-17 | — | — | CN | claimed |
| CN-103288721-B | (4-(4-[6-(trifluoromethylpyridin-3-base amino)-containing N heteroaryl]-phenyl)-cyclohexyl)-acetogenin and pharmaceutical use thereof | NOVARTIS AG (CH) | 2016-04-20 | — | — | CN | claimed |
| CN-104039785-A | Heterocyclylpyrazoles as fungicides | BAYER IP GMBH | 2014-09-10 | — | — | CN | claimed |
| CN-103958518-A | Heterocyclylpyri(mi)dinylpyrazole | BAYER IP GMBH | 2014-07-30 | — | — | CN | claimed |
| CN-103097354-A | Substituted benzamide compounds | GRUENENTHAL CHEMIE | 2013-05-08 | — | — | CN | claimed |
| CN-113490850-B | Diagnostic and therapeutic methods for treating breast cancer | 基因泰克公司 | 2024-12-06 | — | — | CN | disclosed |
| CN-107041367-B | Synergistic fungicidal active combinations | 拜耳作物科学股份公司 | 2019-11-12 | — | — | CN | disclosed |
| CN-106661017-B | Bicyclic or tricyclic heterocyclic compounds | 田边三菱制药株式会社 | 2019-09-24 | — | — | CN | disclosed |
| CN-109928971-A | The amino tetrahydro pyran class compound and application thereof that aryl replaces | 广东东阳光药业有限公司 | 2019-06-25 | — | — | CN | disclosed |
| CN-109071457-A | Inhibitors of indoleamine 2, 3-dioxygenase | 荷兰转化研究中心有限责任公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-109071516-A | novel compounds | 阿斯利康(瑞典)有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-108602809-A | Inhibitors of isoxazolidine derived receptor interacting protein kinase 1(RIPK 1) | 戴纳立制药公司 | 2018-09-28 | — | — | CN | disclosed |
| US-20080262033-A1 | 4-Phenyl-5-Oxo-1,4,5,6,7,8- Hexahydroquinoline Derivatives as Medicaments for the Treatment of Infertility | MERCK SHARP & DOHME B.V. (NL) | 2008-10-23 | — | — | US | disclosed |
| EP-1879581-B1 | 4-PHENYL-5-0X0-l,4,5,6,7,8-HEXAHYDR0QËIN0LINE DERIVATIVES AS MEDICAMENTS FOR THE TREATMENT OF INFERTILITY | ORGANON NV (NL) | 2008-09-03 | — | — | EP | disclosed |
| CN-1100165-C | Improved regenerated collagen fiber and method of manufacturing the same | KANEGAFUCHI CHEMICAL IND (JP) | 2003-01-29 | — | — | CN | disclosed |
| EP-0890663-B1 | Improved regenerated collagen fiber and method of manufacturing the same | KANEKA CORP (JP) | 2002-11-13 | — | — | EP | disclosed |
| US-6160096-A | Regenerated collagen fiber and method of manufacturing the same | KANEKA CORPORATION (JP) | 2000-12-12 | — | — | US | disclosed |
| CN-1207422-A | Improved regenerated collagen fiber and method of manufacturing the same | KANEGAFUCHI CHEMICAL IND (JP) | 1999-02-10 | — | — | CN | disclosed |
| EP-0890663-A2 | Improved regenerated collagen fiber and method of manufacturing the same | Kaneka Corporation (JP) | 1999-01-13 | — | — | EP | disclosed |