SCHEMBL27881007

SCHEMBL27881007

CCCCCc1c[nH]c(C=O)n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.42
HIF1A Q16665 1/20 0.39
EPAS1 Q99814 1/20 0.39
PPARA Q07869 1/20 0.36
ALDH1A1 P00352 1/20 0.35
GPR84 Q9NQS5 7/20 0.34
HCAR2 Q8TDS4 2/20 0.34
HCAR3 P49019 1/20 0.34
LTB4R Q15722 1/20 0.33
PDPK1 O15530 1/20 0.33

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
SCHEMBL9535009 0.98 KCNH2 (0.44) KCNH2HIF1AEPAS1PPARAALDH1A1
SCHEMBL27775876 0.84 KCNH2 (0.43) KCNH2PPARAALDH1A1GPR84HCAR2
SCHEMBL28331952 0.81 KCNH2 (0.44) KCNH2PPARAALDH1A1LTB4R
SCHEMBL18857271 0.81 KCNH2 (0.44) KCNH2PPARAALDH1A1LTB4R
Hydrochloric Acid SCHEMBL31146835 0.80 KCNH2 (0.43) KCNH2PPARAALDH1A1LTB4R
Hydrochloric Acid SCHEMBL31146833 0.80 KCNH2 (0.43) KCNH2PPARAALDH1A1LTB4R
Bromide SCHEMBL28945697 0.80 KCNH2 (0.43) KCNH2PPARAALDH1A1LTB4R
Bromide SCHEMBL31146830 0.80 KCNH2 (0.43) KCNH2PPARAALDH1A1LTB4R
Bromide SCHEMBL28554893 0.80 KCNH2 (0.43) KCNH2PPARAALDH1A1LTB4R
SCHEMBL28047511 0.77 KCNH2 (0.35) KCNH2ALDH1A1PDPK1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102584709-B A kind of preparation technology of the Eprosartan intermediate aryl imidazole aldehyde of improvement 浙江华海药业股份有限公司 2016-08-17 CN claimed
CN-113372215-B Novel esterification method for synthesizing p-halomethyl benzoate 吉林大学 2024-05-24 CN disclosed
CN-113372215-A Novel esterification method for synthesizing p-halomethyl benzoate 吉林大学 2021-09-10 CN disclosed
CN-107216315-A Flavones glyoxaline compound and preparation method thereof 盐城师范学院 2017-09-29 CN disclosed
CN-102584709-B A kind of preparation technology of the Eprosartan intermediate aryl imidazole aldehyde of improvement 浙江华海药业股份有限公司 2016-08-17 CN disclosed
CN-102584709-B A kind of preparation technology of the Eprosartan intermediate aryl imidazole aldehyde of improvement 浙江华海药业股份有限公司 2016-08-17 CN disclosed
CN-102584709-B A kind of preparation technology of the Eprosartan intermediate aryl imidazole aldehyde of improvement 浙江华海药业股份有限公司 2016-08-17 CN disclosed
CN-102584709-A Improved process for preparing aryl imidazole aldehyde serving as eprosartan intermediate ZHEJIANG HUAHAI PHARM CO LTD 2012-07-18 CN disclosed
CN-102584709-A Improved process for preparing aryl imidazole aldehyde serving as eprosartan intermediate ZHEJIANG HUAHAI PHARM CO LTD 2012-07-18 CN disclosed