SCHEMBL4615739

SCHEMBL4615739

CC(C)(C)CO.O=C1OCCO1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL28105187 0.88
SCHEMBL4617559 0.82
Alcohol SCHEMBL9255779 0.81
Alcohol SCHEMBL30902548 0.81 ALDH1A1 (0.35)
Alcohol SCHEMBL5583859 0.79 ALDH1A1 (0.33)
Ethylene Glycol SCHEMBL14167836 0.78 TSHR (0.35)
Methyl Alcohol SCHEMBL1326722 0.78
Propanol SCHEMBL4616364 0.77 NAAA (0.32)
Propane SCHEMBL27666583 0.75
Ethane SCHEMBL28226466 0.74

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108715723-B Electrocoating compositions containing anticrater agent 涂层国外知识产权有限公司 2021-11-02 CN disclosed
US-10577510-B2 Electrocoating composition including an anti-crater agent Axalta Coating Systems IP Co. LLC (US) 2020-03-03 US disclosed
US-20180282557-A1 ELECTROCOATING COMPOSITON INCLUDING AN ANTI-CRATER AGENT AXALTA COATING SYSTEMS IP CO., LLC (US) 2018-10-04 US disclosed
EP-1831317-B1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING AN ANTI-CRATER AGENT DU PONT (US) 2008-03-05 EP disclosed
EP-1819782-B1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING AN ANTI-CRATER AGENT DU PONT (US) 2008-03-05 EP disclosed
US-7264706-B2 Cathodic electrocoating compositions containing an anti-crater agent E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-09-04 US disclosed
US-7264705-B2 Cathodic electrocoating compositions containing an anti-crater agent E. I. DUPONT DE NEMOURS AND COMPANY (US) 2007-09-04 US disclosed
US-20060084725-A1 Cathodic electrocoating compositions containing an anti-crater agent AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2006-04-20 US disclosed
US-20060084726-A1 Cathodic electrocoating compositions containing an anti-crater agent AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2006-04-20 US disclosed
EP-1425354-B1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING HYDROXYL-CARBONATE BLOCKED POLYISOCYANATE CROSSLINKING AGENT DU PONT (US) 2005-03-16 EP disclosed
US-6825361-B2 EPOXY-AMINE ADDUCTS; ELECTRODEPOSITED FINISHES WITH REDUCED WEIGHT LOSS WHEN HEATED TO CURE E. I. DU PONT DE NEMOURS AND COMPANY 2004-11-30 US disclosed
EP-1425354-A1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING HYDROXYL-CARBONATE BLOCKED POLYISOCYANATE CROSSLINKING AGENT E.I. du Pont de Nemours and Company (US) 2004-06-09 EP disclosed
US-20040084313-A1 Cathodic electrocoating compositions containing hydroxyl-carbonate blocked polyisocyanate crosslinking agent PALADIN PHARMA INC. (CA) 2004-05-06 US disclosed
US-6607646-B2 Cathodic electrocoating compositions containing hydroxyl-carbonate blocked polyisocyanate crosslinking agent E. I. DU PONT DE NEMOURS AND COMPANY 2003-08-19 US disclosed
US-20030064227-A1 Cathodic electrocoating compositions containing hydroxyl-carbonate blocked polyisocyanate crosslinking agent E. I. DU PONT DE NEMOURS AND COMPANY 2003-04-03 US disclosed
WO-2003022941-A1 CATHODIC ELECTROCOATING COMPOSITIONS CONTAINING HYDROXYL-CARBONATE BLOCKED POLYISOCYANATE CROSSLINKING AGENT E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-03-20 WO disclosed