SCHEMBL3413337

SCHEMBL3413337

C=C(C)C(=O)OCCOc1c(Br)cc(Br)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 8/20 0.45
POLB P06746 1/20 0.40
APEX1 P27695 1/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
THRA P10827 6/20 0.40
TSHR P16473 3/20 0.40
HSD17B10 Q99714 1/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL5704237 0.96 THRB (0.49) THRBPOLBAPEX1HTTTDP1
SCHEMBL10604787 0.92 TSHR (0.46) THRBPOLBAPEX1HTTTDP1
SCHEMBL11175137 0.88 THRB (0.42) THRBPOLBAPEX1HTTTDP1
SCHEMBL11168121 0.88 THRB (0.44) THRBPOLBAPEX1HTTTDP1
SCHEMBL7062178 0.88 TSHR (0.40) THRBPOLBAPEX1HTTTDP1
SCHEMBL9579758 0.87 THRB (0.41) THRBPOLBAPEX1HTTTDP1
SCHEMBL672151 0.85 ALDH1A1 (0.43) THRBPOLBAPEX1HTTTDP1
SCHEMBL5292693 0.85 THRB (0.41) THRBPOLBAPEX1HTTTDP1
SCHEMBL7218047 0.85 THRB (0.51) THRBPOLBAPEX1HTTTDP1
SCHEMBL13594741 0.84 THRB (0.45) THRBPOLBAPEX1HTTTDP1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0162550-B1 HALOGEN-CONTAINING LENS MATERIAL KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1989-12-13 EP claimed
US-4578445-A Halogen-containing lens material KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-03-25 US claimed
EP-0162550-A2 Halogen-containing lens material KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-11-27 EP claimed
JP-60245613-A None JP disclosed
JP-61296301-A None JP disclosed
US-8378002-B2 Aqueous ink composition, aqueous ink composition for inkjet recording, and inkjet recording method FUJIFILM CORPORATION (JP) 2013-02-19 US disclosed
US-20100015360-A1 AQUEOUS INK COMPOSITION, AQUEOUS INK COMPOSITION FOR INKJET RECORDING, AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-01-21 US disclosed
EP-2145932-A1 Aqueous ink composition, aqueous ink composition for inkjet recording, and inkjet recording method Fujifilm Corporation (JP) 2010-01-20 EP disclosed
US-7217743-B2 Curable white ink KONICA CORPORATION (JP) 2007-05-15 US disclosed
US-6900250-B2 Polymerizable composition TOYO INK MFG. CO., LTD. (JP) 2005-05-31 US disclosed
US-20040019128-A1 Curable white ink KONICA CORPORATION (JP) 2004-01-29 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-0247861-A2 Flame retardant polymer compositions Bromine Compounds Ltd. (IL) 1987-12-02 EP disclosed
US-4710525-A SHELL-CORE ROHM GMBH (DE) 1987-12-01 US disclosed
US-4704006-A HIGH REFRACTIVE INDEX, DYEABILITY, SOLVENT RESISTANCE KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-11-03 US disclosed
JP-S61296301-A LENS MATERIAL KUREHA CHEM IND CO LTD 1986-12-27 JP disclosed
EP-0176874-A2 A highly-refractive plastic lens TORAY INDUSTRIES, INC. (JP) 1986-04-09 EP disclosed
US-4578445-A Halogen-containing lens material KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-03-25 US disclosed
JP-S60245613-A LENS MATERIAL OF GOOD DYEABILITY KUREHA CHEM IND CO LTD 1985-12-05 JP disclosed
EP-0162550-A2 Halogen-containing lens material KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1985-11-27 EP disclosed