⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5334110 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL50752 | 0.75 | ALDH1A1 (0.30) | — | |
| SCHEMBL22832640 | 0.74 | — | — | |
| SCHEMBL8463169 | 0.74 | ALDH1A1 (0.33) | — | |
| SCHEMBL14104841 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL93390 | 0.67 | — | — | |
| SCHEMBL25419169 | 0.66 | — | — | |
| SCHEMBL26645863 | 0.65 | — | — | |
| SCHEMBL2690654 | 0.64 | — | — | |
| Methyl Alcohol SCHEMBL4958474 | 0.62 | FFAR3 (0.32) | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1278712-A2 | NITROAROMATIC SOLUBILIZER FOR NITROXYLS IN AROMATIC SOLVENTS | Uniroyal Chemical Company, Inc. (US) | 2003-01-29 | — | — | EP | claimed |
| EP-1248757-A1 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | Uniroyal Chemical Company, Inc. (US) | 2002-10-16 | — | — | EP | claimed |
| WO-2001083567-A2 | NITROAROMATIC SOLUBILIZER FOR NITROXYLS IN AROMATIC SOLVENTS | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2001-11-08 | — | — | WO | claimed |
| WO-2001053235-A1 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | UNIROYAL CHEMICAL COMPANY, INC. (US) | 2001-07-26 | — | — | WO | claimed |
| US-20150225332-A1 | METHOD FOR PRODUCING ALPHA,BETA-UNSATURATED CARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE AND METHOD FOR PRODUCING 3-ALKOXYCARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE | IDEMITSU KOSAN CO., LTD. (JP) | 2015-08-13 | — | — | US | disclosed |
| US-20140235894-A1 | METHOD FOR PRODUCING ALPHA,BETA-UNSATURATED CARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE AND METHOD FOR PRODUCING 3-ALKOXYCARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE | IDEMITSU KOSAN CO., LTD. (JP) | 2014-08-21 | — | — | US | disclosed |
| US-8748659-B2 | Method for producing alpha,beta-unsaturated carboxylic acid-N,N-disubstituted amide and method for producing 3-alkoxycarboxylic acid-N,N-disubstituted amide | IDEMITSU KOSAN CO., LTD. (JP) | 2014-06-10 | — | — | US | disclosed |
| EP-2664611-A1 | Method for producing alpha,beta-unsaturated carboxylic acid-N,N-disubstituted amide and method for producing 3-alkoxycarboxylic acid-N,N-disubstituted amide | Idemitsu Kosan Co., Ltd (JP) | 2013-11-20 | — | — | EP | disclosed |
| EP-2664610-A1 | Method for producing alpha,beta-unsaturated carboxylic acid-N,N-disubstituted amide and method for producing 3-alkoxycarboxylic acid-N,N-disubstituted amide | Idemitsu Kosan Co., Ltd (JP) | 2013-11-20 | — | — | EP | disclosed |
| US-20120088931-A1 | METHOD FOR PRODUCING ALPHA,BETA-UNSATURATED CARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE AND METHOD FOR PRODUCING 3-ALKOXYCARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE | IDEMITSU KOSAN CO., LTD. (JP) | 2012-04-12 | — | — | US | disclosed |
| EP-2426103-A1 | METHOD FOR PRODUCING ALPHA, BETA-UNSATURATED CARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE AND METHOD FOR PRODUCING 3-ALKOXYCARBOXYLIC ACID-N,N-DISUBSTITUTED AMIDE | Idemitsu Kosan Co., Ltd. (JP) | 2012-03-07 | — | — | EP | disclosed |
| US-20110086981-A1 | MANUFACTURING METHOD FOR SURFACE-MODIFIED RUBBER MOLDED BODY | THE YOKOHAMA RUBBER CO., LTD. | 2011-04-14 | — | — | US | disclosed |
| EP-1913146-A1 | ENZYMATIC PRODUCTION OF (METH)ACRYLIC ACID ESTERS | BASF SE (DE) | 2008-04-23 | — | — | EP | disclosed |
| EP-1856166-A2 | MODIFIED POLYOLEFIN WAXES | BASF AKTIENGESELLSCHAFT (DE) | 2007-11-21 | — | — | EP | disclosed |
| WO-2007014935-A1 | ENZYMATIC PRODUCTION OF (METH)ACRYLIC ACID ESTERS | BASF AKTIENGESELLSCHAFT (DE) | 2007-02-08 | — | — | WO | disclosed |
| WO-2006092425-A2 | MODIFIED POLYOLEFIN WAXES | BASF AKTIENGESELLSCHAFT (DE) | 2006-09-08 | — | — | WO | disclosed |
| EP-1233937-A2 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | Crompton Corporation (US) | 2002-08-28 | — | — | EP | disclosed |
| WO-2001040149-A2 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | CROMPTON CORPORATION (US) | 2001-06-07 | — | — | WO | disclosed |