SCHEMBL992529

SCHEMBL992529

C=C(C)C.C=CC(=O)OCCCC.C=CC(=O)OCCCO

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.76
HPGD P15428 1/20 0.76
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 1/20 0.55
ATM Q13315 1/20 0.53
HCAR2 Q8TDS4 3/20 0.47
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 1/20 0.46
THRB P10828 2/20 0.42
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ACHE P22303 4/20 0.39

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
SCHEMBL669923 0.95 TSHR (0.85) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL11810623 0.93 TSHR (0.88) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL3195579 0.93 TSHR (0.88) TSHRHPGDALDH1A1CYP3A4ATM
Butyl Alcohol SCHEMBL2364286 0.91 TSHR (0.85) TSHRHPGDALDH1A1CYP3A4ATM
1,3-Propanediol SCHEMBL6685901 0.91 TSHR (0.85) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL9776629 0.91 TSHR (0.67) TSHRHPGDALDH1A1CYP3A4ATM
Vinyl Chloride SCHEMBL29163963 0.90 TSHR (0.76) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL27914900 0.89 TSHR (0.81) TSHRHPGDALDH1A1CYP3A4ATM
1,6-Hexanediol SCHEMBL6684029 0.89 TSHR (0.81) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL4359545 0.89 TSHR (0.81) TSHRHPGDALDH1A1CYP3A4ATM

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
EP-2350155-B1 DISPERSION OF HYBRID POLYURETHANE WITH OLEFIN-ACRYLIC COPOLYMERIZATION LUBRIZOL ADVANCED MAT INC (US) 2017-09-20 EP disclosed
EP-2222718-B1 OLEFIN ACRYLATE EMULSION COPOLYMERIZATION LUBRIZOL ADVANCED MAT INC (US) 2016-09-07 EP disclosed
US-9139677-B2 Composite polymer emulsion LUBRIZOL ADVANCED MATERIALS, INC. (US) 2015-09-22 US disclosed
EP-2448983-B1 COMPOSITE POLYMER EMULSION LUBRIZOL ADVANCED MAT INC (US) 2014-09-17 EP disclosed
US-8575256-B2 Dispersion of hybrid polyurethane with olefin-acrylic copolymerization LUBRIZOL ADVANCED MATERIALS, INC. (US) 2013-11-05 US disclosed
US-8476384-B2 Olefin acrylate emulsion copolymerization LUBRIZOL ADVANCED MATERIALS, INC. (US) 2013-07-02 US disclosed
US-20120136109-A1 Composite Polymer Emulsion LUBRIZOL ADVANCED MATERIALS, INC. (US) 2012-05-31 US disclosed
EP-2448983-A1 COMPOSITE POLYMER EMULSION Lubrizol Advanced Materials, Inc. (US) 2012-05-09 EP disclosed
US-20110245399-A1 Dispersion Of Hybrid Polyurethane With Olefin-Acrylic Copolymerization LUBRIZOL ADVANCED MATERIALS, INC. (US) 2011-10-06 US disclosed
WO-2011002831-A1 COMPOSITE POLYMER EMULSION LUBRIZOL ADVANCED MATERIALS, INC. (US) 2011-01-06 WO disclosed
US-20100280198-A1 Olefin Acrylate Emulsion Copolymerization LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-11-04 US disclosed
EP-1732955-B1 METHOD OF MAKING COPOLYMERS CONTAINING OLEFINIC TYPE MONOMERS PPG IND OHIO INC (US) 2008-10-22 EP disclosed
US-7323529-B2 Method of making copolymers containing olefinic type monomers PP6 INDUSTRIES OHIO, INC. (US) 2008-01-29 US disclosed
EP-1732955-A2 METHOD OF MAKING COPOLYMERS CONTAINING OLEFINIC TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2006-12-20 EP disclosed
WO-2005054305-A2 METHOD OF MAKING COPOLYMERS CONTAINING OLEFINIC TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2005-06-16 WO disclosed
US-20050113515-A1 Method of making copolymers containing olefinic type monomers PPG INDUSTRIES OHIO, INC. 2005-05-26 US disclosed