SCHEMBL28009602

SCHEMBL28009602

COc1ccc(C(O)CNC(C)CCc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.59
SLC6A2 P23975 1/20 0.59
SLC6A4 P31645 1/20 0.59
ADRA1A P35348 1/20 0.59
ADRB2 P07550 10/20 0.57
KMT2A Q03164 1/20 0.57
GAA P10253 1/20 0.54
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ADRB3 P13945 4/20 0.51
ADRB1 P08588 3/20 0.51
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
ALDH1A1 P00352 1/20 0.48
KCNJ1 P48048 1/20 0.48
KCNH2 Q12809 1/20 0.48
NPC1 O15118 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
SCHEMBL30637697 0.93 ADRB2 (0.54) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10907492 0.87 ADRB2 (0.76) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10907140 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL8855264 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10710220 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10907139 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10710222 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
SCHEMBL10904955 0.86 ADRB2 (0.59) HTR1ASLC6A2SLC6A4ADRA1AADRB2
Hydrochloric Acid SCHEMBL10907493 0.85 ADRB2 (0.57) HTR1ASLC6A2SLC6A4ADRA1AADRB2
Hydrochloric Acid SCHEMBL10907149 0.85 ADRB2 (0.57) HTR1ASLC6A2SLC6A4ADRA1AADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120005979-A Detection kit for detecting phenylethanolamine A based on ILAMP and detection method thereof 中国计量大学 2025-05-16 CN claimed
CN-110133077-B Phenylethanolamine A detection method based on composite membrane modified electrode and sensor 长沙理工大学 2024-09-17 CN claimed
CN-115356475-B Quick-detection test strip for beta receptor agonist, and preparation method and application thereof 黄淮学院 2024-06-07 CN claimed
CN-117825550-A Method for determining beta-receptor agonist drugs in veterinary drug preparation 石家庄海关技术中心 2024-04-05 CN claimed
CN-117571893-A Ultrasonic probe auxiliary enzymolysis device and method 中国农业科学院农业质量标准与检测技术研究所 2024-02-20 CN claimed
CN-117092227-A Method for rapidly screening multiple veterinary drug residues in milk 黑龙江飞鹤乳业有限公司 2023-11-21 CN claimed
CN-114563507-B Treatment method, detection method and application of beta-receptor agonist residues in animal tissues 中国农业科学院农业质量标准与检测技术研究所 2023-11-10 CN claimed
CN-116660426-B Method for rapidly determining various pesticide veterinary drug residues in animal-derived food and application 山东杰诺检测服务有限公司 2023-10-20 CN claimed
CN-115656396-B Liquid chromatography-mass spectrometry detection method for simultaneously determining multiple beta-receptor agonists in meat 南京农业大学 2023-08-29 CN claimed
CN-116148398-A Method for detecting trace chemical hazard in fat-rich food 北京市疾病预防控制中心 2023-05-23 CN claimed
CN-115656396-A Liquid chromatography-mass spectrometry detection method for simultaneously measuring multiple beta-receptor agonists in meat 南京农业大学 2023-01-31 CN claimed
CN-110665477-B Method for preparing molecularly imprinted polymer 中国农业科学院农业质量标准与检测技术研究所 2022-11-22 CN claimed
CN-115356475-A Rapid detection test paper strip for beta receptor agonist and preparation method and application thereof 黄淮学院 2022-11-18 CN claimed
CN-115128189-A Treatment and confirmation method for detecting beta-receptor agonist drug residue in animal hair sample and application 北京市农产品质量安全中心 2022-09-30 CN claimed
CN-111060638-B Screening and confirming method for 207 veterinary drugs and additives in animal food 河南省兽药饲料监察所(河南省畜产品质量监测检验中心) 2022-06-03 CN claimed
CN-114563507-A Treatment method, detection method and application of beta-receptor agonist residues in animal tissues 中国农业科学院农业质量标准与检测技术研究所 2022-05-31 CN claimed
US-20250172555-A1 DEVICE FOR DETECTION AND PROGNOSTIC ASSESSMENT OF NEURODEGENERATIVE DISORDERS DIADEM SPA (IT) 2025-05-29 US disclosed
CN-120005979-A Detection kit for detecting phenylethanolamine A based on ILAMP and detection method thereof 中国计量大学 2025-05-16 CN disclosed
CN-104459137-B Anti-Phenylethanolamine A monoclonal antibody, antigen detection kit and application BIOLOGY INSTITUTE OF HEBEI ACADEMY OF SCIENCES (CN) 2016-01-13 CN disclosed
CN-104459137-A PEAA (phenylethanolamine A) resisting monoclonal antibody, antigen detection kit and application BIOLOGY INST HEBEI ACADEMY SCIENCES 2015-03-25 CN disclosed