SCHEMBL5174696

SCHEMBL5174696

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.41
HPGD P15428 2/20 0.41
TDP1 Q9NUW8 3/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 2/20 0.35
APEX1 P27695 1/20 0.35
HTT P42858 1/20 0.35
THRB P10828 1/20 0.34
PAM P19021 1/20 0.33
APP P05067 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NAAA Q02083 2/20 0.32
BCHE P06276 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
SCHEMBL10906591 0.97 TSHR (0.43) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL10905439 0.95 TSHR (0.41) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL4445828 0.95 TSHR (0.45) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL18978908 0.94 TDP1 (0.40) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL9770214 0.93 TSHR (0.47) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL8144058 0.93 TDP1 (0.41) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL2462249 0.93 TSHR (0.42) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL2499528 0.93 TSHR (0.42) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL11223220 0.88 ALDH1A1 (0.40) TSHRHPGDTDP1KDM4EPOLB
SCHEMBL10906557 0.87 TSHR (0.41) TSHRHPGDTDP1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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