SCHEMBL2499528

SCHEMBL2499528

C=C(C)C(=O)OCCO.C=C(CC=Cc1ccccc1)C(=O)O.C=CC(=O)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 3/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 2/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
THRB P10828 1/20 0.36
PAM P19021 1/20 0.34
APP P05067 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC3 O15379 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BCHE P06276 1/20 0.32
AKR1B10 O60218 1/20 0.32
AKR1B1 P15121 1/20 0.32

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
SCHEMBL2462249 0.96 TSHR (0.42) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL10906591 0.95 TSHR (0.43) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL10905439 0.93 TSHR (0.41) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL5174696 0.93 TSHR (0.41) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL18978908 0.92 TDP1 (0.40) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL9770214 0.91 TSHR (0.47) TSHRHPGDTDP1KDM4EPOLB
Methacrylic Acid SCHEMBL12490542 0.91 TSHR (0.49) TSHRHPGDTDP1KDM4ETHRB
SCHEMBL8144058 0.91 TDP1 (0.41) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL2711046 0.90 TSHR (0.52) TSHRHPGDTDP1KDM4ETHRB
SCHEMBL5386590 0.90 TDP1 (0.47) TSHRTDP1KDM4EPOLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2797746-A2 BIODEGRADABLE BEVERAGE CARRIER Taccolini, Raymond (US) 2014-11-05 EP disclosed
US-20140300026-A1 BIODEGRADABLE BEVERAGE CARRIER RAYMOND TACCOLINI (US) 2014-10-09 US disclosed
US-20140120277-A1 METHODS FOR MANUFACTURING RECYCLABLE AND REPULPABLE PACKAGING MATERIALS Sustainable Fiber Solutions, LLC (US) 2014-05-01 US disclosed
US-8597733-B2 Methods for manufacturing recyclable and repulpable packaging materials Eco-Friendly Solutions, LLC (US) 2013-12-03 US disclosed
WO-2013101778-A2 BIODEGRADABLE BEVERAGE CARRIER TACCOLINI RAYMOND (US) 2013-07-04 WO disclosed
US-20110244258-A1 METHODS FOR MANUFACTURING RECYCLABLE AND REPULPABLE PACKAGING MATERIALS Eco-Friendly Solutions, LLC (US) 2011-10-06 US disclosed
EP-1474454-B1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG IND OHIO INC (US) 2009-11-18 EP disclosed
US-20060121225-A1 Adhesive NATIONAL STARCH AND CHEMICAL LIMITED (GB) 2006-06-08 US disclosed
EP-1474454-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2004-11-10 EP disclosed
WO-2003070781-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed