⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23545957 | 0.78 | — | — | |
| SCHEMBL2254540 | 0.75 | — | — | |
| SCHEMBL1005740 | 0.75 | — | — | |
| SCHEMBL1005739 | 0.75 | — | — | |
| SCHEMBL1435402 | 0.71 | — | — | |
| SCHEMBL2545831 | 0.71 | — | — | |
| SCHEMBL2545830 | 0.71 | — | — | |
| SCHEMBL2991560 | 0.71 | — | — | |
| SCHEMBL9022856 | 0.71 | — | — | |
| SCHEMBL12193974 | 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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6545043-B1 | Exposing plant, bacterial, fungal or root knot nematodal pests to 4-cyano-3-hydroxy-1-butene, which is a breakdown product of epiprogoitrin present in crambe and mustard plants, or its analog 3-cyano-3-hydroxy-1-propene | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. | 2003-04-08 | — | — | US | claimed |
| EP-3027030-A1 | BIOPESTICIDE COMPOSITIONS COMPRISING WATER SOLUBLE POLYOLS | MPT Mustard Products & Technologies Inc. (CA) | 2016-06-08 | — | — | EP | disclosed |
| EP-3013147-A1 | COMPOSITIONS COMPRISING PESTICIDE PRECURSORS AND METHODS OF MAKING AND USE | MPT Mustard Products & Technologies Inc. (CA) | 2016-05-04 | — | — | EP | disclosed |
| WO-2015013808-A1 | BIOPESTICIDE COMPOSITIONS COMPRISING WATER SOLUBLE POLYOLS | MPT MUSTARD PRODUCTS & TECHNOLOGIES INC. (CA) | 2015-02-05 | — | — | WO | disclosed |
| WO-2014205550-A1 | COMPOSITIONS COMPRISING PESTICIDE PRECURSORS AND METHODS OF MAKING AND USE | MPT MUSTARD PRODUCTS & TECHNOLOGIES INC. (CA) | 2014-12-31 | — | — | WO | disclosed |
| EP-2552219-A1 | COMPOSITIONS COMPRISING PLANT MATERIAL AND SUGAR FOR THE CONTROL OF PESTS AND METHODS OF MAKING | MPT Mustard Products & Technologies Inc. (CA) | 2013-02-06 | — | — | EP | disclosed |
| WO-2011116468-A1 | COMPOSITIONS COMPRISING PLANT MATERIAL AND SUGAR FOR THE CONTROL OF PESTS AND METHODS OF MAKING | MPT MUSTARD PRODUCTS & TECHNOLOGIES INC. (CA) | 2011-09-29 | — | — | WO | disclosed |
| EP-0750004-B1 | PREPREGS AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL | TORAY INDUSTRIES (JP) | 2004-07-07 | — | — | EP | disclosed |
| CN-1125102-C | Amino-propyl bi(amino-ethyl) ether derivative catalyst compsns. | AIR PROD & CHEM (US) | 2003-10-22 | — | — | CN | disclosed |
| CN-1070507-C | Aminopropyl bis (aminoethyl) ether compositions for preparing polyurethanes | AIR PROD & CHEM (US) | 2001-09-05 | — | — | CN | disclosed |
| CN-1306018-A | Amino-propyl bi(amino-ethyl) ether derivative catalyst compsns. | AIR PROD & CHEM (US) | 2001-08-01 | — | — | CN | disclosed |
| CN-1153184-A | Aminopropyl bis (aminoethyl) ether compositions for preparing polyurethanes | AIR PROD & CHEM (US) | 1997-07-02 | — | — | CN | disclosed |
| EP-0750004-A1 | PREPREGS AND CARBON FIBER-REINFORCED COMPOSITE MATERIAL | TORAY INDUSTRIES, INC. (JP) | 1996-12-27 | — | — | EP | disclosed |
| EP-0416789-A2 | Noncircular cross-section carbon fibres, process for producing the same and composite containing them | TORAY INDUSTRIES, INC. (JP) | 1991-03-13 | — | — | EP | disclosed |