SCHEMBL782367

SCHEMBL782367

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

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
HIF1A Q16665 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31

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
Pivalate SCHEMBL9055894 0.83 TDP1 (0.35) TSHRHIF1ACYP2D6CYP2C19TDP1
Allyl Alcohol SCHEMBL27761304 0.83 TSHR (0.43) TSHRHIF1ACYP2D6CYP2C19ALDH1A1
SCHEMBL21340475 0.82 TSHR (0.38) TSHRHIF1ACYP2D6CYP2C19TDP1
Acrylic Acid SCHEMBL11680598 0.79 LMNA (0.48) TSHRHIF1ACYP2D6CYP2C19ALDH1A1
SCHEMBL5365789 0.78 CA1 (0.37) TSHRCYP2D6ALDH1A1MEN1POLB
SCHEMBL26766 0.78
SCHEMBL181160 0.78 TSHR (0.55) TSHRHIF1ACYP2D6CYP2C19ALDH1A1
SCHEMBL7127941 0.77 TSHR (0.41) TSHRHIF1ACYP2D6CYP2C19ALDH1A1
Bicarbonate SCHEMBL15411958 0.77 CYP3A4 (0.42) HIF1ATDP1ALDH1A1TP53CYP3A4
SCHEMBL272881 0.76 CA1 (0.35) TSHRALDH1A1MEN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0674672-B1 AQUEOUS POLYMER DISPERSIONS FOR TRANSPARENT LACQUERS BOLLIG & KEMPER (DE) 1997-07-16 EP claimed
WO-1996013558-A1 UNSATURATED BINDER COMPOSITION PERSTORP AB (SE) 1996-05-09 WO claimed
EP-1654331-B1 PAINT COMPRISING A LIQUID PHASE AND AN ACTIVE POWDER PHASE AKZO NOBEL COATINGS INT BV (NL) 2013-12-11 EP disclosed
US-20120070571-A1 PAINT COMPRISING A LIQUID PHASE AND AN ACTIVE POWDER PHASE AKZO NOBEL COATINGS INTERNATIONAL B.V. (NL) 2012-03-22 US disclosed
US-8048482-B2 Paint comprising a liquid phase and an active powder phase AKZO NOBEL COATINGS INTERNATIONAL B.V. (NL) 2011-11-01 US disclosed
EP-1285035-B1 AQUEOUS CROSS-LINKABLE BINDER COMPOSITION AND COATING, LACQUER OR SEALING COMPOSITION COMPRISING SUCH A BINDER COMPOSITION AKZO NOBEL COATINGS INT BV (NL) 2007-07-11 EP disclosed
US-20060222765-A1 Paint comprising a liquid phase and an active powder phase AKZO NOBEL COATING INTERNATIONAL B.V. (NL) 2006-10-05 US disclosed
EP-1654331-A1 PAINT COMPRISING A LIQUID PHASE AND AN ACTIVE POWDER PHASE Akzo Nobel Coatings International B.V. (NL) 2006-05-10 EP disclosed
WO-2005017054-A1 PAINT COMPRISING A LIQUID PHASE AND AN ACTIVE POWDER PHASE AKZO NOBEL COATINGS INTERNATIONAL B.V. (NL) 2005-02-24 WO disclosed
EP-1285035-A1 AQUEOUS CROSS-LINKABLE BINDER COMPOSITION AND COATING, LACQUER OR SEALING COMPOSITION COMPRISING SUCH A BINDER COMPOSITION Akzo Nobel N.V. (NL) 2003-02-26 EP disclosed
US-6509408-B2 Comprising an aqueous dispersion of a polyester-polyacrylate graft copolymer of given hydroxyl number, acid value and sulfonic acid content and an organic polyisocyanate AKZO NOBEL N.V. (NL) 2003-01-21 US disclosed
US-20020016407-A1 Aqueous cross-linkable binder composition and coating, lacquer or sealing composition comprising such a binder composition AKZO NOBEL N.V. (NL) 2002-02-07 US disclosed
WO-2001090265-A1 AQUEOUS CROSS-LINKABLE BINDER COMPOSITION AND COATING, LACQUER OR SEALING COMPOSITION COMPRISING SUCH A BINDER COMPOSITION AKZO NOBEL N.V. (NL) 2001-11-29 WO disclosed
WO-1996013558-A1 UNSATURATED BINDER COMPOSITION PERSTORP AB (SE) 1996-05-09 WO disclosed