SCHEMBL6442653

SCHEMBL6442653

C=CC(=O)OCCOc1c(Br)cc(C(C)(C)c2cc(Br)c(OCCO)c(Br)c2)cc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.44
THRB P10828 8/20 0.42
ALDH1A1 P00352 6/20 0.40
HIF1A Q16665 4/20 0.37
TP53 P04637 3/20 0.37
HSD17B10 Q99714 2/20 0.37
HPGD P15428 2/20 0.35
CYP3A4 P08684 4/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
CASP1 P29466 1/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
THRA P10827 6/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL372646 0.95 THRB (0.46) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL15500139 0.90 THRB (0.42) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL10790892 0.90 TSHR (0.47) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL10610244 0.90 TSHR (0.38) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL6439976 0.89 ALDH1A1 (0.41) TSHRTHRBALDH1A1HIF1AHSD17B10
SCHEMBL23422359 0.85 THRB (0.38) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL10409149 0.82 ALDH1A1 (0.40) TSHRTHRBALDH1A1HIF1AHSD17B10
SCHEMBL25899 0.82 ALDH1A1 (0.54) TSHRTHRBALDH1A1HIF1AHSD17B10
SCHEMBL11171804 0.82 THRB (0.46) TSHRTHRBALDH1A1HIF1ATP53
SCHEMBL23293901 0.81 ALDH1A1 (0.43) TSHRTHRBALDH1A1HIF1AHSD17B10

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-1474719-A4 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS LLC (US) 2005-12-14 EP claimed
US-20050090612-A1 Polymerization process and materials for biomedical applications ZMS, L.L.C.; A CALIFORNIA LIMITED LIABILITY CORPORATION 2005-04-28 US claimed
EP-1474719-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2004-11-10 EP claimed
WO-2003071339-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2003-08-28 WO claimed
EP-1474719-A4 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS LLC (US) 2005-12-14 EP disclosed
US-20050090612-A1 Polymerization process and materials for biomedical applications ZMS, L.L.C.; A CALIFORNIA LIMITED LIABILITY CORPORATION 2005-04-28 US disclosed
EP-1474719-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2004-11-10 EP disclosed
WO-2003071339-A1 POLYMERIZATION PROCESS AND MATERIALS FOR BIOMEDICAL APPLICATIONS ZMS, LLC (US) 2003-08-28 WO disclosed
US-4931523-A HIGH DYEABILITY, REFRACTIVE INDEX KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1990-06-05 US disclosed
US-4812032-A DIBROMOSTYRENE, DIVINYLBENZENE, HALOGEN CONTAINING ACRYLATE OR METHACRYLATE TORAY INDUSTRIES, INC. (JP) 1989-03-14 US disclosed
US-4721377-A COPOLYMER OF DIBROMOSTYRENE, DI-(OR TRI-) (METH-)ACRYLATE AND MONO (METH-)ACRYLATE TORAY INDUSTRIES, INC. (JP) 1988-01-26 US disclosed
EP-0134861-B1 RESIN MATERIAL FOR PLASTIC LENS AND LENS COMPOSED THEREOF TORAY INDUSTRIES, INC. (JP) 1987-12-09 EP disclosed
EP-0187958-A2 Resin for information recording medium TORAY INDUSTRIES, INC. (JP) 1986-07-23 EP disclosed
EP-0176874-A2 A highly-refractive plastic lens TORAY INDUSTRIES, INC. (JP) 1986-04-09 EP disclosed
EP-0134861-A1 Resin material for plastic lens and lens composed thereof TORAY INDUSTRIES, INC. (JP) 1985-03-27 EP disclosed
US-4487904-A Urethanized acrylic resin material for plastic lens and lens composed thereof TORAY INDUSTRIES, INC. (JP) 1984-12-11 US disclosed