SCHEMBL4445828

SCHEMBL4445828

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

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.45
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 2/20 0.40
THRB P10828 2/20 0.38
PAM P19021 1/20 0.36
APP P05067 1/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.34
AKR1B10 O60218 1/20 0.34
AKR1B1 P15121 1/20 0.34
NAAA Q02083 2/20 0.34
BCHE P06276 2/20 0.34
THRA P10827 1/20 0.33
ACHE P22303 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL5174696 0.95 TSHR (0.41) TSHRHPGDKDM4ETDP1THRB
SCHEMBL9770214 0.94 TSHR (0.47) TSHRHPGDKDM4ETDP1THRB
SCHEMBL10906591 0.92 TSHR (0.43) TSHRHPGDKDM4ETDP1THRB
SCHEMBL2462249 0.91 TSHR (0.42) TSHRHPGDKDM4ETDP1THRB
SCHEMBL10905439 0.90 TSHR (0.41) TSHRHPGDKDM4ETDP1THRB
SCHEMBL4579799 0.89 TSHR (0.46) TSHRHPGDKDM4ETDP1THRB
Acrylic Acid Ethyl Ester SCHEMBL7900245 0.89 TSHR (0.46) TSHRHPGDKDM4ETDP1THRB
SCHEMBL8144058 0.89 TDP1 (0.41) TSHRHPGDKDM4ETDP1THRB
SCHEMBL11413027 0.89 KDM4E (0.40) TSHRHPGDKDM4ETDP1THRB
SCHEMBL18978908 0.89 TDP1 (0.40) TSHRHPGDKDM4ETDP1THRB

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 20 patents. 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 disclosed
EP-1474456-B1 ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG IND OHIO INC (US) 2007-03-14 EP disclosed
US-7132476-B2 Thermosetting compositions containing alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. (US) 2006-11-07 US disclosed
US-7125931-B2 Thermosetting compositions containing alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. (US) 2006-10-24 US disclosed
US-6992137-B2 Alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. (US) 2006-01-31 US disclosed
US-20040245114-A1 Thermosetting compositions containing alternating copolymers of isobutylene type monomers COCA SIMION (US) 2004-12-09 US disclosed
US-20040242777-A1 Thermosetting compositions containing alternating copolymers of isobutylene type monomers COCA SIMION (US) 2004-12-02 US disclosed
EP-1474457-A1 METHOD OF MAKING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2004-11-10 EP disclosed
EP-1474454-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2004-11-10 EP disclosed
EP-1474456-A1 ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG Industries Ohio, Inc. (US) 2004-11-10 EP disclosed
US-20040176558-A1 Alternating copolymers of isobutylene type monomers COCA SIMION (US) 2004-09-09 US disclosed
US-6784248-B2 CROSSLINKED BLEND; ELECTRODEPOSITION PPG INDUSTRIES OHIO, INC. 2004-08-31 US disclosed
US-6686432-B2 For use as flow control agents in thermosetting electrocoating of conductive substrates serving as electrodes in electrical circuits PPG INDUSTRIES OHIO, INC. 2004-02-03 US disclosed
US-6677422-B2 MIXING MOLAR EXCESS OF DONOR MONOMER WITH ETHYLENICALLY UNSATURATED ACCEPTOR MONOMER, POLYMERIZING IN PRESENCE OF FREE RADICAL POLYMERIZATION INITIATOR, FORMING POLYMER CONTAINING ALTERNATING DONOR-ACCEPTOR SEGMENTS PPG INDUSTRIES OHIO, INC. 2004-01-13 US disclosed
US-20030171497-A1 Thermosetting compositions containing alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. 2003-09-11 US disclosed
US-20030171515-A1 Method of making alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. 2003-09-11 US disclosed
US-20030170394-A1 Alternating copolymers of isobutylene type monomers PPG INDUSTRIES OHIO, INC. 2003-09-11 US disclosed
WO-2003070781-A1 THERMOSETTING COMPOSITIONS CONTAINING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed
WO-2003070793-A1 ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed
WO-2003070794-A1 METHOD OF MAKING ALTERNATING COPOLYMERS OF ISOBUTYLENE TYPE MONOMERS PPG INDUSTRIES OHIO, INC. (US) 2003-08-28 WO disclosed