⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28421175 | 0.81 | — | — | |
| SCHEMBL1553372 | 0.81 | — | — | |
| Water SCHEMBL11361709 | 0.79 | — | — | |
| SCHEMBL29597118 | 0.77 | — | — | |
| Tetrahydrofuran SCHEMBL27896184 | 0.71 | ALDH1A1 (0.47) | — | |
| Fluoride SCHEMBL15271293 | 0.69 | — | — | |
| SCHEMBL19985099 | 0.69 | ALDH1A1 (0.35) | — | |
| SCHEMBL2077666 | 0.67 | — | — | |
| SCHEMBL14683300 | 0.67 | — | — | |
| SCHEMBL31121561 | 0.67 | — | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3931236-A | Oxidation and dehydrohalogenation of halotetrahydropyrans | PHILLIPS PETROLEUM COMPANY (US) | 1976-01-06 | — | — | US | claimed |
| CN-115279847-B | Active energy ray-curable ink and image recording method | 富士胶片株式会社 | 2023-10-27 | — | — | CN | disclosed |
| US-20220098171-A1 | 5-(4-PYRIDYLOXY)PYRAZOLE COMPOUNDS SERVING AS TGF-ßR1 KINASE INHIBITOR | JIANGSU AOSAIKANG PHARMACEUTICAL CO., LTD. (CN) | 2022-03-31 | — | — | US | disclosed |
| EP-2638036-B1 | COMPOUND FOR INCREASING KINASE ACTIVE AND APPLICATION THEREOF | BETTA PHARMACEUTICALS CO LTD (CN) | 2017-08-16 | — | — | EP | disclosed |
| EP-3083714-A1 | CATALYST FOR THE POLYMERIZATION OF OLEFINS | Basell Poliolefine Italia S.r.l. (IT) | 2016-10-26 | — | — | EP | disclosed |
| US-9409900-B2 | Compound for increasing kinase active and application thereof | FUJIAN HAIXI PHARMACEUTICALS, INC. (CN) | 2016-08-09 | — | — | US | disclosed |
| WO-2015091320-A1 | CATALYST FOR THE POLYMERIZATION OF OLEFINS | BASELL POLIOLEFINE ITALIA S.R.L. (IT) | 2015-06-25 | — | — | WO | disclosed |
| EP-2638036-A1 | COMPOUND FOR INCREASING KINASE ACTIVE AND APPLICATION THEREOF | Zhejiang Beta Pharma Incorporation (CN) | 2013-09-18 | — | — | EP | disclosed |
| US-20130225587-A1 | COMPOUND FOR INCREASING KINASE ACTIVE AND APPLICATION THEREOF | ZHEJIANG BETA PHARMA INCORPORATION (CN) | 2013-08-29 | — | — | US | disclosed |
| WO-2012062210-A1 | COMPOUND FOR INCREASING KINASE ACTIVE AND APPLICATION THEREOF | ZHEJIANG BETA PHARMA INC. (CN) | 2012-05-18 | — | — | WO | disclosed |
| CN-101282730-A | Phosphate antigen salt of organic base and crystallization method thereof | INNATE PHARMA (FR) | 2008-10-08 | — | — | CN | disclosed |
| EP-1355886-A1 | FUSED HETEROCYCLIC COMPOUNDS | Takeda Chemical Industries, Ltd. (JP) | 2003-10-29 | — | — | EP | disclosed |
| WO-2002062764-A1 | FUSED HETEROCYCLIC COMPOUNDS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2002-08-15 | — | — | WO | disclosed |
| EP-0741702-A4 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA INC (US) | 1997-12-03 | — | — | EP | disclosed |
| EP-0741702-A1 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA, INC. (US) | 1996-11-13 | — | — | EP | disclosed |
| WO-1995020574-A1 | PROCESS FOR PREPARING 2-OXINDOLE-1-CARBOXAMIDES | CATALYTICA, INC. (US) | 1995-08-03 | — | — | WO | disclosed |
| US-3931236-A | Oxidation and dehydrohalogenation of halotetrahydropyrans | PHILLIPS PETROLEUM COMPANY (US) | 1976-01-06 | — | — | US | disclosed |