SCHEMBL1194445

SCHEMBL1194445

C=CC=C(C)C(=O)OC(=O)C(C)=CCC=C

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
SCHEMBL16618080 0.90 ALDH1A1 (0.32)
SCHEMBL8817639 0.85
SCHEMBL8849384 0.83 ALDH1A1 (0.32)
SCHEMBL4260220 0.83 ALDH1A1 (0.37)
SCHEMBL9640027 0.80 CYP2D6 (0.31)
SCHEMBL4928401 0.79
SCHEMBL8554370 0.77 TSHR (0.38)
SCHEMBL28797840 0.77 CYP2D6 (0.33)
SCHEMBL3468724 0.76 MGAM (0.39)
SCHEMBL175303 0.76 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2681595-B1 PROCESS FOR PREPARING MOLDED OPTICAL ARTICLES PPG IND OHIO INC (US) 2015-02-18 EP claimed
EP-2559721-B1 Compositions and articles prepared from thioether functional oligomeric polythiols PPG IND OHIO INC (US) 2015-01-07 EP claimed
US-8848288-B2 Composite optical articles PPG INDUSTRIES OHIO, INC. (US) 2014-09-30 US claimed
EP-2559721-A1 Compositions and articles prepared from thioether functional oligomeric polythiols PPG Industries Ohio, Inc. (US) 2013-02-20 EP claimed
EP-2016115-B1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG IND OHIO INC (US) 2013-01-02 EP claimed
US-20120286435-A1 PROCESS FOR PREPARING MOLDED OPTICAL ARTICLES PPG INDUSTRIES OHIO, INC. (US) 2012-11-15 US claimed
WO-2012121997-A1 POLYTHIOURETHAN BASED COMPOSITE ARTICLES PPG INDUSTRIES OHIO, INC. (US) 2012-09-13 WO claimed
WO-2012121905-A1 PROCESS FOR PREPARING MOLDED OPTICAL ARTICLES PPG INDUSTRIES OHIO, INC. (US) 2012-09-13 WO claimed
US-20120224139-A1 COMPOSITE OPTICAL ARTICLES PPG INDUSTRIES OHIO, INC. (US) 2012-09-06 US claimed
US-7696296-B2 Compositions and articles prepared from the thioether functional oligomeric polythiols PPG INDUSTRIES OHIO, INC. (US) 2010-04-13 US claimed
US-7553925-B2 Thioether functional oligomeric polythiols and articles prepared therefrom PPG INDUSTRIES OHIO, INC. (US) 2009-06-30 US claimed
EP-2024420-A2 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG Industries Ohio, Inc. (US) 2009-02-18 EP claimed
EP-2016115-A1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG Industries Ohio, Inc. (US) 2009-01-21 EP claimed
US-20080125570-A1 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG INDUSTRIES OHIO, INC. (US) 2008-05-29 US claimed
US-20070270548-A1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG INDUSTRIES OHIO, INC. (US) 2007-11-22 US claimed
WO-2007131150-A2 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO claimed
WO-2007131145-A1 COMPOSITIONS AND ARTICLES PREPARED FROM THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO claimed
EP-3080180-B1 POLYURETHANE UREA-CONTAINING COMPOSITIONS AND OPTICAL ARTICLES AND METHODS FOR PREPARING THEM PPG IND OHIO INC (US) 2021-02-03 EP disclosed
WO-2007131148-A1 POLYUREA/POLYTHIOUREA COATINGS PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO disclosed
WO-2007131149-A1 THIOETHER FUNCTIONAL OLIGOMERIC POLYTHIOLS AND ARTICLES PREPARED THEREFROM PPG INDUSTRIES OHIO, INC. (US) 2007-11-15 WO disclosed