SCHEMBL4340169

SCHEMBL4340169

Oc1c(Br)cc(Br)cc1Br.[NaH]

nearest known ligand 0.93

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.93
TSHR P16473 2/20 0.93
TDP1 Q9NUW8 2/20 0.93
GABRA1 P14867 2/20 0.68
GABRB1 P18505 2/20 0.68
GABRA2 P47869 1/20 0.68
GABRB2 P47870 1/20 0.68
AKR1C4 P17516 1/20 0.54
AKR1C3 P42330 1/20 0.54
AKR1C2 P52895 1/20 0.54
AKR1C1 Q04828 1/20 0.54
ERN1 O75460 1/20 0.54
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
HPGD P15428 2/20 0.48
LMNA P02545 2/20 0.48
MAPT P10636 2/20 0.48
HTT P42858 2/20 0.48
ATM Q13315 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL18224 0.97 CYP3A4 (1.00) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL11020188 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL10546483 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
Iodide SCHEMBL28328087 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
Hydrogen Sulfide SCHEMBL27992646 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL29858952 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL11020186 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
SCHEMBL28015082 0.93 CYP3A4 (0.93) CYP3A4TSHRTDP1GABRA1GABRB1
Formic Acid SCHEMBL27515766 0.83 CYP3A4 (0.74) CYP3A4TSHRTDP1GABRA1GABRB1
Bromophene SCHEMBL31323101 0.81 GABRA1 (1.00) CYP3A4TSHRTDP1GABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115819194-A Synthesis method of 1,3, 5-tribromo-2- (2, 3-dibromo-2-methylpropyloxy) benzene 山东润科化工股份有限公司 2023-03-21 CN claimed
CN-108821960-A Coloured flame-retardant agent four(Tribromophenoxy)1,4-benzoquinone compound and preparation method thereof 苏州科技大学 2018-11-16 CN claimed
CN-103539947-B Graft modification super high molecular weight polyacrylamide and preparation method thereof 中国石油化工股份有限公司 2016-06-08 CN claimed
CN-104650133-A Preparation method of fire retardant dimethyl silicate bis(2,4,6-tribromophenyl)ester compound SUZHOU YANGQIAO CHEMICAL ENGINEERING TECHNOLOGY CO LTD 2015-05-27 CN claimed
CN-103539947-A Graft-modified ultrahigh-molecular-weight polyacrylamide and preparation method thereof CHINA PETROLEUM & CHEMICAL 2014-01-29 CN claimed
CN-115819194-A Synthesis method of 1,3, 5-tribromo-2- (2, 3-dibromo-2-methylpropyloxy) benzene 山东润科化工股份有限公司 2023-03-21 CN disclosed
CN-115819194-A Synthesis method of 1,3, 5-tribromo-2- (2, 3-dibromo-2-methylpropyloxy) benzene 山东润科化工股份有限公司 2023-03-21 CN disclosed
CN-113788950-B Polyphosphazene and preparation method and application thereof 山东泰星新材料股份有限公司 2022-08-23 CN disclosed
CN-113788950-B Polyphosphazene and preparation method and application thereof 山东泰星新材料股份有限公司 2022-08-23 CN disclosed
CN-113788950-A Polyphosphazene and preparation method and application thereof 山东泰星新材料股份有限公司 2021-12-14 CN disclosed
CN-113788950-A Polyphosphazene and preparation method and application thereof 山东泰星新材料股份有限公司 2021-12-14 CN disclosed
CN-108821960-B Colored flame retardant tetra (tribromophenoxy) p-benzoquinone compound and preparation method thereof 苏州科技大学 2021-10-26 CN disclosed
CN-103539947-B Graft modification super high molecular weight polyacrylamide and preparation method thereof 中国石油化工股份有限公司 2016-06-08 CN disclosed
CN-104650133-A Preparation method of fire retardant dimethyl silicate bis(2,4,6-tribromophenyl)ester compound SUZHOU YANGQIAO CHEMICAL ENGINEERING TECHNOLOGY CO LTD 2015-05-27 CN disclosed
CN-104650133-A Preparation method of fire retardant dimethyl silicate bis(2,4,6-tribromophenyl)ester compound SUZHOU YANGQIAO CHEMICAL ENGINEERING TECHNOLOGY CO LTD 2015-05-27 CN disclosed
CN-101531591-B Dicarboxylic acid monobromophenyl ester rare earth salt and preparation method and application thereof HUAIHAI INST TECHNOLOGY 2012-05-30 CN disclosed
CN-102414183-A Flame-retardant composition for combustible plastic materials comprising 2,4, 6-tris (2,4, 6-tribromophenoxy) -1,3, 5-triazine and process for producing said flame-retardant composition DAI ICHI KOGYO SEIYAKU CO LTD 2012-04-11 CN disclosed
CN-101531591-A Dicarboxylic acid monobromobenzene ester rare earth salt and preparation method and application thereof HUAIHAI INST TECHNOLOGY 2009-09-16 CN disclosed
US-7514139-B2 A fiber, sheet or textile of a polyurethane formed from an anionic bis(hydroxy(oxy)alkyl) di- or oligoester prepared from a dicarboxylic acid containing one or two sulfonate, sulfate or sulfamate groups (e.g., 5-sulfoisophthalic acid); moisture-absorbing/releasing properties and dyeability SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-07 US disclosed
US-20060182922-A1 Polyol component for polyurethane formation comprising anionic diol and composition SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2006-08-17 US disclosed