SCHEMBL94457

SCHEMBL94457

C=CC(C(C)=O)C(N)=O

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
SCHEMBL29182964 0.83
SCHEMBL10939771 0.83
SCHEMBL28092283 0.80 ALDH1A1 (0.42)
SCHEMBL27952939 0.80 ALDH1A1 (0.42)
SCHEMBL183653 0.76
SCHEMBL7140623 0.76
SCHEMBL28027033 0.76
SCHEMBL4108683 0.76
SCHEMBL218285 0.76
SCHEMBL1618008 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 271 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109865-A1 WATER-BORNE COATING COMPOSITION AXALTA COATING SYSTEMS IP CO., LLC (US) 2026-04-23 US claimed
US-20260109875-A1 MULTI-PART WATER-BORNE COATING COMPOSITION AXALTA COATING SYSTEMS IP CO., LLC (US) 2026-04-23 US claimed
EP-2855608-B1 WATER-BASED POLYMER COMPOSITIONS FOR PRINTING INKS AND COATINGS BASF SE (DE) 2017-07-12 EP claimed
US-9365731-B2 Water-based polymer compositions for printing inks and coatings BASF SE (DE) 2016-06-14 US claimed
US-20150166803-A1 WATER-BASED POLYMER COMPOSITIONS FOR PRINTING INKS AND COATINGS BAST SE (DE) 2015-06-18 US claimed
EP-2855608-A2 WATER-BASED POLYMER COMPOSITIONS FOR PRINTING INKS AND COATINGS BASF SE (DE) 2015-04-08 EP claimed
CN-104364327-A Water-based polymer compositions for printing inks and coatings BASF SE 2015-02-18 CN claimed
CN-103524966-A Aqueous polymer dispersons for stabilizing actives ROHM & HAAS 2014-01-22 CN claimed
WO-2013181068-A2 WATER-BASED POLYMER COMPOSITIONS FOR PRINTING INKS AND COATINGS BASF SE (DE) 2013-12-05 WO claimed
EP-1798258-B1 Polymer composition ROHM & HAAS (US) 2011-03-16 EP claimed
CN-101010366-A Coating composition with improved stability NOVEON INC (US) 2007-08-01 CN claimed
US-7241834-B2 Forming an aqueous coating comprising an aqueous acrylic emulsion polymer, applying coating to a substrate; and drying, or allowing to dry applied coating ROHM AND HAAS COMPANY (US) 2007-07-10 US claimed
EP-1798258-A1 Polymer composition Rohm and Haas Company (US) 2007-06-20 EP claimed
CN-1982347-A Polymer composition ROHM & HAAS (US) 2007-06-20 CN claimed
EP-1789486-A1 COATING COMPOSITIONS HAVING IMPROVED STABILITY Noveon, Inc. (US) 2007-05-30 EP claimed
WO-2006026379-A1 COATING COMPOSITIONS HAVING IMPROVED STABILITY NOVEON, INC. (US) 2006-03-09 WO claimed
US-20060047062-A1 Coating compositions having improved stability LUBRIZOL ADVANCED MATERIALS, INC. 2006-03-02 US claimed
US-6727314-B2 BLEND OF POLYMER COMPRISING ACETOACETOXYETHYL (METH)ACRYLATE AND CASTOR OIL (METH)ACRYLATE COMONOMERS BASF AG (DE) 2004-04-27 US claimed
US-20030195297-A1 Crosslinking systems for acrylic latex films BASF AG (DE) 2003-10-16 US claimed
WO-2003051990-A1 ACRYLIC LATEX FILMS BASED ON CASTOR OIL (METH)ACRYLATE DERIVATIVES BASF AG (DE) 2003-06-26 WO claimed