SCHEMBL305496

SCHEMBL305496

CC(=O)CCCOC(C)=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.61
CHRM5 P08912 2/20 0.46
CHRM1 P11229 2/20 0.46
CHRM3 P20309 2/20 0.46
PGR P06401 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
HTR1A P08908 1/20 0.46
CHRNB2 P17787 1/20 0.46
TBXA2R P21731 1/20 0.46
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
CHRNA7 P36544 1/20 0.46
CHRNA4 P43681 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRNA10 Q9GZZ6 1/20 0.46
CHRNA9 Q9UGM1 1/20 0.46
TSHR P16473 1/20 0.46
GALR3 O60755 2/20 0.44
GAA P10253 1/20 0.44

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
SCHEMBL6128478 0.92 ALDH1A1 (0.58) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL26695702 0.91 ALDH1A1 (0.52) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL26695716 0.91 ALDH1A1 (0.52) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL5182293 0.90 ALDH1A1 (0.56) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL5165893 0.90 ALDH1A1 (0.56) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL5468558 0.90 ALDH1A1 (0.56) ALDH1A1CHRM5CHRM1CHRM3PGR
SCHEMBL4940227 0.90 ALDH1A1 (0.56) ALDH1A1CHRM5CHRM1CHRM3PGR
Acetic Acid Butyl Ester SCHEMBL4356071 0.84 ALDH1A1 (0.75) ALDH1A1TSHR
SCHEMBL21057919 0.84 ALDH1A1 (0.45) ALDH1A1TSHRLMNAHSD17B10ACHE
SCHEMBL40578 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117417245-A Method for synthesizing ketoprofen through pyrolytic aromatization reaction 复旦大学 2024-01-19 CN claimed
CN-114544852-B Improved urine retention capsule quality detection method 贵州远程制药有限责任公司 2023-11-21 CN claimed
CN-115591585-B Organic aluminum-SiO 2 Aerogel-like catalyst and preparation method thereof 贵州大学 2023-09-19 CN claimed
CN-115591585-A Organic aluminum-SiO 2 Type aerogel catalyst and preparation method thereof 贵州大学(CN) 2023-01-13 CN claimed
CN-112679498-B Quaternary ammonium sulfonate compound and preparation method and application thereof 北京耀诚惠仁科技有限公司 2022-11-29 CN claimed
CN-111732587-B Abamebactam intermediate compound gemini quaternary ammonium disulfonate and preparation method thereof 北京耀诚惠仁科技有限公司 2022-11-25 CN claimed
CN-112920323-B beta-N-methylamino-L-alanine molecularly imprinted polymer 吉林省食品检验所(吉林省食品生产许可证审核中心) 2022-10-11 CN claimed
CN-113046047-B Preparation method of temperature-resistant surfactant for oil displacement 重庆化工职业学院 2022-09-27 CN claimed
CN-111808595-B Application of biquaternary ammonium salt surfactant in viscosity reduction of thick oil 中国石油大学(华东) 2022-09-09 CN claimed
CN-114544852-A Improved quality detection method for Longqing capsule 贵州远程制药有限责任公司 2022-05-27 CN claimed
CN-102397453-A Preparation method of rhinitis treating tablet SUZHOU PAITENG BIOLOG MEDICAL TECHNOLOGY CO LTD 2012-04-04 CN claimed
CN-102276515-A Method for extracting deoxynojirimycin 2011-12-14 CN claimed
CN-102267991-A Neonicotinoid clothianidin compound, preparation method and application thereof 2011-12-07 CN claimed
CN-102070629-A Novel nicotine and clothianidin analogue pesticide and preparation method thereof UNIV SHANGHAI 2011-05-25 CN claimed
CN-102060788-A Method for preparing bi-pyrazinamide crystals HUNAN TIANCHENG PHARMACEUTICAL COMPANY LTD 2011-05-18 CN claimed
CN-101863725-A Method for preparing nano catalytic composite materials by utilizing integrating process of ultrasonic-film-anti-solvent method UNIV NANJING NORMAL 2010-10-20 CN claimed
CN-101402609-B Method for synthesis of 5-bromine-3-sec-butyl-6- methyl uracil YIYUAN XINQUAN CHEMICAL CO LTD 2010-08-18 CN claimed
CN-101402609-A Method for synthesis of 5-bromine-3-sec-butyl-6- methyl uracil YIYUAN XINQUAN CHEMICAL CO LTD (CN) 2009-04-08 CN claimed
CN-1317005-C Dragon's blood extract with alpha-glycosidase inhibiting activity and its prepn making process and use UNIV SHANGHAI (CN) 2007-05-23 CN claimed
CN-1739707-A Dragon's blood extract with alpha-glycosidase inhibiting activity and its prepn making process and use UNIV SHANGHAI (CN) 2006-03-01 CN claimed