⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8064977 | 1.00 | — | — | |
| SCHEMBL4293263 | 1.00 | — | — | |
| SCHEMBL135519 | 0.93 | HTT (0.41) | — | |
| SCHEMBL7936971 | 0.93 | HTT (0.41) | — | |
| SCHEMBL14939100 | 0.91 | HTT (0.45) | — | |
| SCHEMBL9146283 | 0.91 | HTT (0.45) | — | |
| SCHEMBL14939101 | 0.91 | HTT (0.45) | — | |
| SCHEMBL9050529 | 0.91 | HTT (0.45) | — | |
| SCHEMBL9148832 | 0.91 | HTT (0.45) | — | |
| SCHEMBL14938976 | 0.91 | HTT (0.45) | — |
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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0906299-B1 | PROCESS FOR PREPARING TETRAHYDROFURAN FROM DIALKOXYBUTENES | BASF AG (DE) | 2004-08-04 | — | — | EP | claimed |
| US-6245948-B1 | REACTING 2-BUTENOL ETHERS IN PRESENCE OF METATHESIS CATALYST TO GIVE BUTENE AND CORRESPONDING 1,4-BUTENEDIOL DIETHERS | BASF AKTIENGESELLSCHAFT (DE) | 2001-06-12 | — | — | US | claimed |
| US-6169189-B1 | REACTING DIALKOXYBUTENES WITH WATER AND HYDROGEN IN PRESENCE OF CATALYSTS OR CATALYST COMBINATIONS WHICH ARE BOTH CAPABLE OF HYDROGENATION AND HAVE ACIDIC OR BASIC CENTERS | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-02 | — | — | US | claimed |
| EP-0906299-A1 | PROCESS FOR PREPARING TETRAHYDROFURAN FROM DIALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1999-04-07 | — | — | EP | claimed |
| WO-1997046546-A1 | PROCESS FOR PREPARING TETRAHYDROFURAN FROM DIALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1997-12-11 | — | — | WO | claimed |
| US-20170174609-A1 | PROCESS FOR DOUBLE CARBONYLATION OF ALLYL ETHERS TO CORRESPONDING DIESTERS | EVONIK DEGUSSA GMBH (DE) | 2017-06-22 | — | — | US | disclosed |
| EP-3181547-A1 | METHOD FOR DOUBLE CARBONYLATION OF ALLYL ETHERS TO CORRESPONDING DIESTERS | Evonik Degussa GmbH (DE) | 2017-06-21 | — | — | EP | disclosed |
| US-20100081693-A1 | THIADIAZOLE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-01 | — | — | US | disclosed |
| US-20100081693-A1 | THIADIAZOLE COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-04-01 | — | — | US | disclosed |
| EP-1330309-B1 | CATALYST SYSTEM AND METHOD FOR CARBONYLATION | BASF AG (DE) | 2006-04-05 | — | — | EP | disclosed |
| US-6916954-B2 | Catalyst system and method for carbonylation | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-12 | — | — | US | disclosed |
| EP-0906299-B1 | PROCESS FOR PREPARING TETRAHYDROFURAN FROM DIALKOXYBUTENES | BASF AG (DE) | 2004-08-04 | — | — | EP | disclosed |
| WO-1998041494-A1 | METHOD FOR PRODUCING N-BUTYRALDEHYDE AND/OR N-BUTANOL | BASF AKTIENGESELLSCHAFT (DE) | 1998-09-24 | — | — | WO | disclosed |
| WO-1998012164-A2 | PROCESS FOR PRODUCING n-BUTYLALKYL ETHERS | BASF AKTIENGESELLSCHAFT (DE) | 1998-03-26 | — | — | WO | disclosed |
| WO-1998012165-A2 | PROCESS FOR PRODUCING ALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1998-03-26 | — | — | WO | disclosed |
| EP-0815070-A1 | METHOD OF PRODUCING 3-PENTENIC ACID ESTERS BY CARBONYLATION OF ALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1998-01-07 | — | — | EP | disclosed |
| WO-1997046546-A1 | PROCESS FOR PREPARING TETRAHYDROFURAN FROM DIALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1997-12-11 | — | — | WO | disclosed |
| EP-0739332-A1 | PROCESS FOR PRODUCING n-BUTYRALDEHYDE AND/OR n-BUTANOL | BASF AKTIENGESELLSCHAFT (DE) | 1996-10-30 | — | — | EP | disclosed |
| WO-1996029300-A1 | METHOD OF PRODUCING 3-PENTENIC ACID ESTERS BY CARBONYLATION OF ALKOXYBUTENES | BASF AKTIENGESELLSCHAFT (DE) | 1996-09-26 | — | — | WO | disclosed |
| WO-1995019334-A1 | PROCESS FOR PRODUCING n-BUTYRALDEHYDE AND/OR n-BUTANOL | BASF AKTIENGESELLSCHAFT (DE) | 1995-07-20 | — | — | WO | disclosed |