SCHEMBL7599115

SCHEMBL7599115

C=CCOc1c(Br)cc(S(=O)(=O)c2cc(Br)c(OCC=C)c(Br)c2)cc1Br

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.37
PKM P14618 1/20 0.37
KMT2A Q03164 6/20 0.36
MEN1 O00255 5/20 0.36
GAA P10253 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 4/20 0.34
MAPT P10636 4/20 0.34
HTT P42858 2/20 0.34
POLB P06746 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL10500362 1.00 CA12 (0.45) CA12CA1CA2CA7CA9
SCHEMBL5148421 0.92 CA12 (0.40) CA12CA1CA2CA7CA9
SCHEMBL11174499 0.85 CA1 (0.36) CA12CA1CA2CA7CA9
SCHEMBL10883638 0.80 CYP3A4 (0.34) CA12CA1CA2CA7CA9
SCHEMBL42433 0.79 LMNA (0.45) CA12CA1CA2CA7CA9
SCHEMBL7600877 0.79 LMNA (0.45) CA12CA1CA2CA7CA9
SCHEMBL11171075 0.79 CYP3A4 (0.35) CA12CA1CA2CA7CA9
SCHEMBL9618034 0.79 POLB (0.51) CA12CA1CA2CA7CA9
SCHEMBL4131111 0.78 THRA (0.32) KMT2AMEN1
SCHEMBL11174496 0.77 CA12 (0.32) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110894331-B Environment-friendly low-smoke flame-retardant HIPS material and preparation method thereof 天津金发新材料有限公司 2022-04-08 CN claimed
CN-110894331-A Environment-friendly low-smoke flame-retardant HIPS material and preparation method thereof 天津金发新材料有限公司 2020-03-20 CN claimed
CN-106249620-A A kind of drilling device based on eM Plant analogue system and method for work thereof 徐州工程学院 2016-12-21 CN claimed
CN-102898337-A Method for producing granular flame retardant tetrabromobisphenol S ether UNIV CHINA THREE GORGES CTGU 2013-01-30 CN claimed
EP-0211140-B1 PROCESS FOR PREPARING BIS-(4-HYDROXY-3,5-DIBROMO-PHENYL)-SULFONE DERIVATIVES MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1989-11-08 EP claimed
US-4777297-A ETHERIFICATION IN ALKALINE SOLUTION WITH BROMIDE OR IODIDE MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1988-10-11 US claimed
JP-5140083-A None JP disclosed
JP-5140081-A None JP disclosed
JP-5310684-A None JP disclosed
JP-3044366-A None JP disclosed
JP-4095058-A None JP disclosed
JP-3271267-A None JP disclosed
JP-3093768-A None JP disclosed
JP-H03271267-A PRODUCTION OF BIS(3,5-DIBROMO-4-(DIBROMOPROPOXY)PHENYL) SULFONE TOSOH CORP 1991-12-03 JP disclosed
US-5068446-A Crystallization and heat treatment MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1991-11-26 US disclosed
JP-H0393768-A PRODUCTION OF BIS(4-ALLYLOXY-3,5-DIBROMOPHENYL)SULFONE TOSOH CORP 1991-04-18 JP disclosed
JP-H0344366-A PRERATION OF 3,5,3',5'-TETRABROMO-4,4'-DIALLYLOXYDIPHEYL SULFONE KYOEI YUKI KK 1991-02-26 JP disclosed
EP-0211140-B1 PROCESS FOR PREPARING BIS-(4-HYDROXY-3,5-DIBROMO-PHENYL)-SULFONE DERIVATIVES MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1989-11-08 EP disclosed
US-4777297-A ETHERIFICATION IN ALKALINE SOLUTION WITH BROMIDE OR IODIDE MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1988-10-11 US disclosed
EP-0211140-A1 Process for preparing bis-(4-hydroxy-3,5-dibromo-phenyl)-sulfone derivatives MARUBISHI YUKA KOGYO KABUSHIKI KAISHA (JP) 1987-02-25 EP disclosed