SCHEMBL282083

SCHEMBL282083

CCOC(=O)CCCCBr

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.61
ALDH1A1 P00352 3/20 0.58
TRPA1 O75762 1/20 0.58
GAA P10253 2/20 0.50
ALOX15 P16050 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP3A4 P08684 2/20 0.50
MGAM O43451 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
DGKA P23743 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NR1I2 O75469 1/20 0.48
PGR P06401 1/20 0.48
ADORA3 P0DMS8 1/20 0.48
PTGS2 P35354 1/20 0.48
PDE4D Q08499 1/20 0.48
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47

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
SCHEMBL318062 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL1703446 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL3862786 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL7034021 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL19638401 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL24597734 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL47126 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL52706 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL1005765 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15
SCHEMBL31049888 0.98 CYP1A2 (0.59) CYP1A2ALDH1A1TRPA1GAAALOX15

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

Appears in 2219 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250076325-A1 ARTIFICIAL HAPTEN AND ARTIFICIAL ANTIGEN OF FENTANYL, AND PREPARATION METHOD AND APPLICATION THEREOF HANGZHOU ALLTEST BIOTECH CO LTD (CN) 2025-03-06 US claimed
CN-119001078-A Paraquat rapid detection method and detection box thereof 深圳市绿诗源生物技术有限公司 2024-11-22 CN claimed
CN-118852640-A Supermolecule assembly with spermine response and preparation method and application thereof 重庆医科大学附属儿童医院 2024-10-29 CN claimed
CN-118598746-A Synthetic method and application of S- (-) -6, 8-dichloro ethyl octanoate 湖北楚维药业有限公司 2024-09-06 CN claimed
CN-118420465-A Preparation method of ethyl 8-hydroxy-6-oxo-octoate 苏州富士莱医药股份有限公司 2024-08-02 CN claimed
CN-118221674-A Pyrrolo [3,2-b ] pyridine Top/HDAC double-target inhibitor, preparation method, pharmaceutical composition and application thereof 南京市鸿舜医药科技有限公司 2024-06-21 CN claimed
CN-118184939-A High-performance polyurethane and preparation method and application thereof 中国科学院长春应用化学研究所 2024-06-14 CN claimed
CN-117776923-A Crocetin diester compound and application thereof in liver cancer cell resistance 常州大学 2024-03-29 CN claimed
CN-117659341-A Preparation method of modified chain extender for synthesizing polyurethane and zwitterionic polyurethane 上海陕煤高新技术研究院有限公司 2024-03-08 CN claimed
CN-117126102-A Artificial hapten and artificial antigen of fentanyl as well as preparation methods and application thereof 杭州奥泰生物技术股份有限公司 2023-11-28 CN claimed
CN-102070449-B Preparation method of 5-halogenated pentanoate ZHEJIANG MED XINCHANG PHARM 2013-11-06 CN claimed
CN-103172525-A Preparation method of ethyl vanillin antigen and antibody, and application of ethyl vanillin antigen and antibody UNIV SOUTH CHINA AGRICULT 2013-06-26 CN claimed
CN-103130712-A Paraquat hapten, paraquat complete antigen and preparation method of paraquat hapten and paraquat complete antigen INST HYGIENE & ENVIRONMETNAL MEDICINE ACADEMY MILITARY MEDICAL SCIENCES 2013-06-05 CN claimed
CN-102659939-A Diphenylhydantoin immunogen, diphenylhydantoin specificity-resistant antibody and diphenylhydantoin detection reagent JIAXING JIUQIJIU BIOLOG TECHNOLOGY CO LTD 2012-09-12 CN claimed
CN-102636637-A Methods for detecting phenytoin JIAXING JIUQIJIU BIOLOG TECHNOLOGY CO LTD 2012-08-15 CN claimed
CN-102633876-A Synthetic method and application of paraquat antigen UNIV JIANGNAN 2012-08-15 CN claimed
CN-102617729-A Tacrolimus immunogen, anti-tacrolimus specific antigen and tacrolimus detection reagent SUZHOU BOYUAN MEDICAL TECHNOLOGY CO LTD 2012-08-01 CN claimed
CN-102070449-A Preparation method of 5-halogenated pentanoate ZHEJIANG MED XINCHANG PHARM 2011-05-25 CN claimed
CN-101941953-A Nitrogenous heterocyclic substituted hydrazide compounds as well as preparation methods and applications thereof SHENZHEN XIANGYA BIOPHARMACEUTICAL INST 2011-01-12 CN claimed
CN-101717349-A Preparation method and applications of intermediate modifier of Sudan red I NANJING UNIVERSITY OF TECHNOLOGY 2010-06-02 CN claimed