SCHEMBL28079403

SCHEMBL28079403

COc1c(N2CCNCC2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12.[NaH]

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.79
ALDH1A1 P00352 6/20 0.79
HPGD P15428 5/20 0.79
KCNH2 Q12809 4/20 0.79
HSD17B10 Q99714 3/20 0.79
POLB P06746 3/20 0.79
TDP1 Q9NUW8 2/20 0.79
OPRM1 P35372 2/20 0.79
PRKD3 O94806 1/20 0.79
ALOX15 P16050 1/20 0.79
CLK2 P49760 1/20 0.79
CLK4 Q9HAZ1 1/20 0.79
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
LMNA P02545 3/20 0.63
CYP1A2 P05177 1/20 0.60
TOP2A P11388 1/20 0.60
CYP2C9 P11712 1/20 0.60
TOP2B Q02880 1/20 0.60
CYP2C19 P33261 1/20 0.58

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
SCHEMBL1155026 0.99 KDM4E (0.80) KDM4EALDH1A1HPGDKCNH2HSD17B10
Methyl Alcohol SCHEMBL29163210 0.98 KDM4E (0.79) KDM4EALDH1A1HPGDKCNH2HSD17B10
Water SCHEMBL27625917 0.98 KDM4E (0.79) KDM4EALDH1A1HPGDKCNH2HSD17B10
SCHEMBL27918942 0.98 KDM4E (0.79) KDM4EALDH1A1HPGDKCNH2HSD17B10
Hydrochloric Acid SCHEMBL9751979 0.98 KDM4E (0.79) KDM4EALDH1A1HPGDKCNH2HSD17B10
Water SCHEMBL28828205 0.98 KDM4E (0.79) KDM4EALDH1A1HPGDKCNH2HSD17B10
Acetic Acid SCHEMBL28525396 0.97 KDM4E (0.77) KDM4EALDH1A1HPGDKCNH2HSD17B10
SCHEMBL9773833 0.95 KDM4E (0.75) KDM4EALDH1A1HPGDKCNH2HSD17B10
SCHEMBL27002955 0.95 KDM4E (0.74) KDM4EALDH1A1HPGDKCNH2HSD17B10
SCHEMBL11975675 0.94 KDM4E (0.81) KDM4EALDH1A1HPGDKCNH2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107727957-B A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2019-10-11 CN claimed
CN-108333208-A A kind of complete machine grade product storage-life accelerated test method 航天科工防御技术研究试验中心 2018-07-27 CN claimed
CN-107727957-A A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2018-02-23 CN claimed
CN-103344862-B A kind of electronic equipment integrated environment accelerated storage test device 北京航空航天大学 2016-08-10 CN claimed
CN-103576009-B Multilayer ceramic capacitor Gatifloxacin sodium for injection method 中国运载火箭技术研究院 2016-08-10 CN claimed
CN-105806877-A Novel evaluation test method of long-term storage life of CMOS device 中国电子科技集团公司第五十八研究所 2016-07-27 CN claimed
CN-107727957-B A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2019-10-11 CN disclosed
CN-107727957-B A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2019-10-11 CN disclosed
CN-107727957-B A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2019-10-11 CN disclosed
CN-108333208-A A kind of complete machine grade product storage-life accelerated test method 航天科工防御技术研究试验中心 2018-07-27 CN disclosed
CN-107727957-A A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2018-02-23 CN disclosed
CN-107727957-A A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2018-02-23 CN disclosed
CN-107727957-A A kind of electric connector Gatifloxacin sodium for injection method 浙江理工大学 2018-02-23 CN disclosed
CN-106446317-A Mathematic model-based sealed relay storage life prediction method 河北工业大学 2017-02-22 CN disclosed
CN-103576009-B Multilayer ceramic capacitor Gatifloxacin sodium for injection method 中国运载火箭技术研究院 2016-08-10 CN disclosed
CN-103576009-B Multilayer ceramic capacitor Gatifloxacin sodium for injection method 中国运载火箭技术研究院 2016-08-10 CN disclosed
CN-103576009-B Multilayer ceramic capacitor Gatifloxacin sodium for injection method 中国运载火箭技术研究院 2016-08-10 CN disclosed
CN-103344862-B A kind of electronic equipment integrated environment accelerated storage test device 北京航空航天大学 2016-08-10 CN disclosed
CN-103344862-B A kind of electronic equipment integrated environment accelerated storage test device 北京航空航天大学 2016-08-10 CN disclosed
CN-105806877-A Novel evaluation test method of long-term storage life of CMOS device 中国电子科技集团公司第五十八研究所 2016-07-27 CN disclosed