SCHEMBL3197733

SCHEMBL3197733

O=COc1c(Br)cc(Br)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 2/20 0.40
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 2/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
ALOX15 P16050 4/20 0.34
ALOX12 P18054 3/20 0.34
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
KMT2A Q03164 3/20 0.32
PTPN1 P18031 1/20 0.32
AKR1B1 P15121 1/20 0.31
AKR1C4 P17516 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
AKR1C1 Q04828 1/20 0.31
HSP90AA1 P07900 1/20 0.31
TLR9 Q9NR96 1/20 0.31

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
SCHEMBL28084920 0.83 CYP19A1 (0.41) ERN1CYP3A4TSHRKMT2AALDH1A1
SCHEMBL16469385 0.76 MAPT (0.32) MAPT
SCHEMBL12841384 0.76 CRHBP (0.45) ERN1HSD17B10TDP1CYP3A4TSHR
SCHEMBL12826104 0.76 ALDH1A1 (0.47) HSD17B10TDP1CYP3A4TSHRALOX15
SCHEMBL3390811 0.75 TDP1 (0.36) ERN1HSD17B10TDP1CYP3A4TSHR
SCHEMBL1045001 0.75 HSD17B10 (0.39) ERN1HSD17B10TDP1CYP3A4TSHR
SCHEMBL27486986 0.75 ALOX15 (0.39) ERN1TDP1CYP3A4TSHRALOX15
SCHEMBL18875293 0.72 ERN1 (0.32) ERN1ALDH1A1
SCHEMBL3194381 0.72 SOD1 (0.34) ERN1ALDH1A1
SCHEMBL20836258 0.71 HSD17B10 (0.37) HSD17B10TDP1CYP3A4TSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106086160-A A kind of test kit measuring 5'Nueleotidme and preparation method thereof 安徽伊普诺康生物技术股份有限公司 2016-11-09 CN claimed
CN-105838350-A Electrochromic composite material and prepared electrochromic device 吉林大学 2016-08-10 CN claimed
CN-103267758-B Dry chemical method rapid diagnostic reagent strip for testing content of alcohol in saliva and preparation method thereof ZHEJIANG ORIENT GENE BIOTECH CO LTD 2015-05-13 CN claimed
CN-103529020-A Lactic acid measurement kit SHAOXING SHENGKANG BIOLOGY TECHNOLOGY CO LTD 2014-01-22 CN claimed
CN-103267758-A Dry chemical method rapid diagnostic reagent strip for testing content of alcohol in saliva and preparation method thereof ZHEJIANG ORIENT GENE BIOTECH CO LTD 2013-08-28 CN claimed
CN-106086160-A A kind of test kit measuring 5'Nueleotidme and preparation method thereof 安徽伊普诺康生物技术股份有限公司 2016-11-09 CN disclosed
CN-105925246-A Electricity generated acid produced by blending substances with changeable oxidation state and electrolyte and applications thereof 吉林大学 2016-09-07 CN disclosed
CN-105522839-A Water writing paper capable of being repeatedly used UNIV JILIN 2016-04-27 CN disclosed
CN-105500968-A Reusable water writing paper UNIV JILIN 2016-04-20 CN disclosed
CN-104684562-A Plant extracts for improving cognitive health and function KEMIN IND INC 2015-06-03 CN disclosed
CN-103267758-B Dry chemical method rapid diagnostic reagent strip for testing content of alcohol in saliva and preparation method thereof ZHEJIANG ORIENT GENE BIOTECH CO LTD 2015-05-13 CN disclosed
CN-101448773-B Metal complexes for use in the carbonylation of ethylenically unsaturated compounds LUCITE INT UK LTD 2015-02-11 CN disclosed
CN-1522374-A Plastic lens material, plastic lens composition, plastic lens obtained by curing the composition, and method for producing the plastic lens 昭和电工株式会社 2004-08-18 CN disclosed
CN-1422723-A Soldering tin paste SENSUMI METAL INDUSTRY CO LTD (JP) 2003-06-11 CN disclosed
CN-1070169-C Process for carbonylation of butadiene or butadiene derivative DSM NV (NL) 2001-08-29 CN disclosed
CN-1138021-A Process for carbonylation of butadiene or butadiene derivative DSM NV (NL) 1996-12-18 CN disclosed
CN-1019799-B Insatiable hunger is closed the method for olefin(e) compound carbonylation with palladium catalyst SHELL INT RESEARCH (NL) 1992-12-30 CN disclosed
CN-1019193-B Process for carbonylation of ethylenically unsaturated compounds with palladium catalyst SHELL INT RESEARCH (NL) 1992-11-25 CN disclosed
CN-88101206-A The method of the carbonylation of ethylenically unsaturated compounds under palladium catalyst 1988-09-28 CN disclosed
CN-87101635-A Insatiable hunger is closed the method for olefin(e) compound carbonylation with palladium catalyst 1988-01-20 CN disclosed