SCHEMBL896579

SCHEMBL896579

COc1oc2cccc(OC)c2c(=O)c1-c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.57
ALDH1A1 P00352 7/20 0.56
KDM4E B2RXH2 5/20 0.56
CYP3A4 P08684 4/20 0.56
MAPT P10636 4/20 0.56
TP53 P04637 3/20 0.56
HSD17B10 Q99714 3/20 0.56
AR P10275 2/20 0.56
HPGD P15428 2/20 0.56
ADORA3 P0DMS8 1/20 0.47
ESR1 P03372 1/20 0.47
KDM5A P29375 1/20 0.47
ESR2 Q92731 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
LMNA P02545 1/20 0.46
EDNRA P25101 1/20 0.44
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
MEN1 O00255 2/20 0.43

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
SCHEMBL27934311 0.85 ALDH1A1 (0.44) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL1001259 0.83 ABCG2 (0.60) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL6724444 0.83 CYP3A4 (0.51) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL11244826 0.82 MEN1 (0.52) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL27728665 0.82 MGAM (0.50) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL4287360 0.81 ALDH1A1 (0.55) MAOAALDH1A1CYP3A4MAPTTP53
SCHEMBL27696055 0.79 ADORA3 (0.50) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL17237780 0.78 MAOA (0.59) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL7496403 0.78 ADORA3 (0.51) MAOAALDH1A1KDM4ECYP3A4MAPT
SCHEMBL27728663 0.78 ABCB1 (0.57) ALDH1A1KDM4ECYP3A4MAPTADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111574489-B Synthetic method of 3',4', 7-trihydroxyisoflavone 中国人民解放军联勤保障部队第九〇四医院 2022-04-29 CN claimed
CN-111574490-B Synthesis method of polyhydroxy isoflavone 中国人民解放军联勤保障部队第九〇四医院 2022-04-29 CN claimed
CN-111560000-B Synthesis method of polyhydroxy isoflavone 中国人民解放军联勤保障部队第九〇四医院 2022-04-12 CN claimed
CN-111606881-B Synthesis method of 3',4',5',6,7, 8-hexahydroxy isoflavone and application thereof in antioxidation 中国人民解放军联勤保障部队第九〇四医院 2022-03-11 CN claimed
CN-113512018-A Flavonoid compound and preparation method and application thereof 合肥工业大学 2021-10-19 CN claimed
CN-111606881-A Synthesis method of 3 ', 4 ', 5 ', 6, 7, 8-hexahydroxy isoflavone and application thereof in antioxidation 中国人民解放军联勤保障部队第九〇四医院 2020-09-01 CN claimed
CN-111574489-A Synthesis method of 3 ', 4', 7-trihydroxyisoflavone 中国人民解放军联勤保障部队第九〇四医院 2020-08-25 CN claimed
CN-111574490-A Synthesis method of polyhydroxy isoflavone 中国人民解放军联勤保障部队第九〇四医院 2020-08-25 CN claimed
CN-111560000-A Synthesis method of polyhydroxy isoflavone 中国人民解放军联勤保障部队第九〇四医院 2020-08-21 CN claimed
CN-107163015-B A kind of isoflavone compound and the preparation method and application thereof that can improve cigarette smoking effect 云南中烟工业有限责任公司 2019-08-09 CN claimed
CN-103087027-B Preparation process of polyhydroxy isoflavone COLLEGE OF MILITARY PREVENTIVE MEDICINE THIRD MILITARY MEDICAL UNIVERSITY OF PLA 2014-11-19 CN claimed
CN-103030647-B Method for synthesizing glabridin SHANDONG ANALYSIS TEST CENTER (CN) 2014-10-29 CN claimed
CN-103087027-A Preparation process of polyhydroxy isoflavone MILITARY PREVENTION MEDICAL COLLEGE THIRD MILITARY MEDICAL UNIVERSITY OF PLA 2013-05-08 CN claimed
CN-106134378-B A kind of preparation method of trihydroxy-isoflavone 中国人民解放军第三军医大学 2013-03-13 CN claimed
CN-101456845-B 4,5-diaryl-2-sulfhydryl miazines compounds and synthetic method thereof and pharmaceutical use UNIV SHAANXI NORMAL 2010-11-03 CN claimed
CN-101495183-A Treating muscular disorders and improving muscular function DSM IP ASSETS BV (NL) 2009-07-29 CN claimed
CN-101456845-A 4,5-diaryl-2-sulfhydryl miazines compounds and synthetic method thereof and pharmaceutical use UNIV SHAANXI NORMAL (CN) 2009-06-17 CN claimed
CN-101343253-A 2-amido-4, 5-diaryl miazines compound, preparation and pharmaceutical use thereof UNIV SHAANXI NORMAL (CN) 2009-01-14 CN claimed
CN-101020662-A Compound 3,4-diaryl pyrazole and its prepn and medicinal use UNIV SHAANXI NORMAL (CN) 2007-08-22 CN claimed
CN-1984648-A Botanical extract compositions and methods of use MEDICAL RES AND EDUCATION ASSO (US) 2007-06-20 CN claimed