SCHEMBL3462014

SCHEMBL3462014

O=C=NCCCC1CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
SIGMAR1 Q99720 3/20 0.42
KEAP1 Q14145 2/20 0.37
NFE2L2 Q16236 2/20 0.37
ALDH1A1 P00352 1/20 0.37
EPHX1 P07099 1/20 0.34
KDM5A P29375 2/20 0.33
PHF8 Q9UPP1 2/20 0.33
KDM2A Q9Y2K7 2/20 0.33
KDM4C Q9H3R0 1/20 0.33
KDM4A O75164 1/20 0.33
CEL P19835 1/20 0.33
HPGD P15428 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL20798645 1.00 CYP1A2 (0.45) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL19853228 1.00 CYP1A2 (0.45) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL19969578 1.00 CYP1A2 (0.45) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL19849589 1.00 CYP1A2 (0.45) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL2310653 0.94 SIGMAR1 (0.45) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL28555544 0.92 SIGMAR1 (0.48) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL9088702 0.92 SIGMAR1 (0.48) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL28521877 0.92 SIGMAR1 (0.48) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL28528633 0.92 SIGMAR1 (0.48) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1
SCHEMBL10445994 0.92 SIGMAR1 (0.42) CYP1A2SIGMAR1KEAP1NFE2L2ALDH1A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117004301-A Solvent-borne coating composition suitable for forming a coating on three-piece food or beverage cans 广东华润涂料有限公司 2023-11-07 CN disclosed
CN-116368203-A Process for preparing aqueous titanium dioxide slurries, slurries produced thereby and coating compositions containing same 巴斯夫涂料有限公司 2023-06-30 CN disclosed
CN-116323823-A Aqueous low solids basecoat compositions 巴斯夫涂料有限公司 2023-06-23 CN disclosed
CN-116113673-A Low reflectivity dual cure adhesive composition 汉高股份有限及两合公司 2023-05-12 CN disclosed
CN-114929590-A Packaging coating system SWIMC有限公司 2022-08-19 CN disclosed
CN-107207689-B Polymers, coating compositions, coated articles, and methods related thereto 宣伟投资管理有限公司 2021-09-24 CN disclosed
CN-109476806-B Hybrid system for producing an aqueous repair coating, production method and aqueous repair coating produced from said hybrid system 巴斯夫涂料有限公司 2021-03-30 CN disclosed
CN-109476136-B Aqueous dispersions comprising polymers prepared in stages with polyurethanes and coating compositions comprising them 巴斯夫涂料有限公司 2021-01-29 CN disclosed
EP-3727862-A1 POWDER-BASED ADDITIVE MANUFACTURING PROCESS Covestro Deutschland AG (DE) 2020-10-28 EP disclosed
EP-3487702-A1 AQUEOUS DISPERSIONS CONTAINING POLYMERIZATES PRODUCED IN MULTIPLE STAGES WITH POLYURETHANES AS WELL AS COATING AGENT COMPOSITIONS CONTAINING SAME BASF Coatings GmbH (DE) 2019-05-29 EP disclosed
EP-2190936-A2 USE OF BISMUTH SUBNITRATE IN ELECTRO-DIPPING PAINTS BASF Coatings GmbH (DE) 2010-06-02 EP disclosed
WO-2009118172-A1 CATHODIC ELECTRODEPOSITION COATINGS CONTAINING POLYMETHYLENE UREA BASF COATINGS AG (DE) 2009-10-01 WO disclosed
WO-2009021719-A2 USE OF BISMUTH SUBNITRATE IN ELECTRO-DIPPING PAINTS BASF COATINGS AG (DE) 2009-02-19 WO disclosed
US-20040198851-A1 Polyurethane foams BASF AKTIENGESELLSCHAFT (DE) 2004-10-07 US disclosed
US-6777090-B2 ONE COMPONENT SYSTEM WHERE BINDER AND CROSSLINKER AVOID PREMATURE CROSSLINKING DUE TO ABSENCE OF ISOCYANATE REACTIVE GROUPS; ADHESIVES, COATINGS, SEALANTS; ISOCYANATE, ACID, AND EPOXIDE REACTIVE GROUPS; CARBAMATE GROUPS BASF COATINGS AG (DE) 2004-08-17 US disclosed
US-20030091833-A1 Substance mixture which can be cured thermally and by using actinic radiation,and the use thereof BASF COATINGS AKTIENGESELLSCHAFT (DE) 2003-05-15 US disclosed
US-20030032719-A1 Aqueous coating material that can be hardened thermally and/or by using actinic radiation and, the use thereof BASF COATINGS AKTIENGESELLSCHAFT (DE) 2003-02-13 US disclosed
EP-0393006-A1 Bonding polyvinyl butyral and polyurethane and method for obtaining same MONSANTO COMPANY (US) 1990-10-17 EP disclosed
US-4948672-A PLASTICIZED POLYVINYL BUTYRAL CHEMICALLY LINKED TO THERMOSET POLYURETHANE LAYER MONSANTO COMPANY (US) 1990-08-14 US disclosed
US-4937147-A Laminate of plasticized polyvinyl butyral and polyurethane MONSANTO COMPANY (US) 1990-06-26 US disclosed