SCHEMBL4453596

SCHEMBL4453596

C=C(C)C(=O)OCC(C)OC(N)=O

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.66
LMNA P02545 2/20 0.44
CHRM2 P08172 1/20 0.44
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
CYP2C9 P11712 1/20 0.44
MAPT P10636 1/20 0.43
ALDH1A1 P00352 2/20 0.40
THRB P10828 1/20 0.39
TDP1 Q9NUW8 1/20 0.34
ALOX15 P16050 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 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
SCHEMBL160208 0.86 TSHR (0.73) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL5908014 0.85 TSHR (0.55) TSHRLMNACHRM2CHRM4CHRM5
SCHEMBL28211208 0.85 TSHR (0.70) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL5027278 0.85 TSHR (0.70) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL8503165 0.85 TSHR (0.70) TSHRCHRM2CHRM4CHRM1MAPT
Ethylene SCHEMBL2156738 0.85 TSHR (0.70) TSHRCHRM2CHRM4CHRM1MAPT
Water SCHEMBL7715061 0.85 TSHR (0.70) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL13171047 0.83 TSHR (0.57) TSHRLMNACHRM2CHRM4CHRM5
SCHEMBL16803291 0.82 TSHR (0.67) TSHRCHRM2CHRM4CHRM1MAPT
SCHEMBL7154371 0.81 TSHR (0.66) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474454-B1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG IND OHIO INC (US) 2009-11-18 EP claimed
JP-4219277-B2 2009-02-04 JP claimed
EP-1474479-B1 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG IND OHIO INC (US) 2008-08-06 EP claimed
EP-1786872-A1 POWDER COATING COMPOSITIONS PPG Industries Ohio, Inc. (US) 2007-05-23 EP claimed
US-7132477-B2 Powder coating compositions PPG INDUSTRIES OHIO, INC. (US) 2006-11-07 US claimed
WO-2006026492-A1 POWDER COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2006-03-09 WO claimed
JP-2005517790-A 2005-06-16 JP claimed
US-20050025987-A1 Powder coating compositions PPG INDUSTRIES OHIO INC. 2005-02-03 US claimed
EP-1474479-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG Industries Ohio, Inc. (US) 2004-11-10 EP claimed
US-6784248-B2 CROSSLINKED BLEND; ELECTRODEPOSITION PPG INDUSTRIES OHIO, INC. 2004-08-31 US claimed
US-6784247-B2 FILM FORMING; CROSSLINKING PPG INDUSTRIES OHIO, INC. 2004-08-31 US claimed
US-20030166787-A1 Powder coating compositions having improved mar and acid resistance PPG INDUSTRIES OHIO, INC. 2003-09-04 US claimed
WO-2003070826-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO claimed
EP-1474479-B1 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG IND OHIO INC (US) 2008-08-06 EP disclosed
EP-1651684-B1 ETHERIFIED CARBAMATE FUNCTIONAL COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS, AND THEIR USE IN CURABLE COMPOSITIONS PPG IND OHIO INC (US) 2007-11-07 EP disclosed
EP-1786872-A1 POWDER COATING COMPOSITIONS PPG Industries Ohio, Inc. (US) 2007-05-23 EP disclosed
US-6784247-B2 FILM FORMING; CROSSLINKING PPG INDUSTRIES OHIO, INC. 2004-08-31 US disclosed
US-20030166787-A1 Powder coating compositions having improved mar and acid resistance PPG INDUSTRIES OHIO, INC. 2003-09-04 US disclosed
WO-2003070826-A2 POWDER COATING COMPOSITIONS HAVING IMPROVED MAR AND ACID RESISTANCE PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed
US-4165266-A LIQUID MONOACRYLATE MONOMER AND A POLYVINYL ALKYL ETHER, QUICK STICKING UNION CARBIDE CORPORATION (US) 1979-08-21 US disclosed