SCHEMBL28083168

SCHEMBL28083168

C=C(Cl)OC(=O)CC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.50
GAA P10253 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
TDP1 Q9NUW8 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.30
KDM6B O15054 1/20 0.30
KDM5C P41229 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
PHF8 Q9UPP1 1/20 0.30
KDM2A Q9Y2K7 1/20 0.30

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
SCHEMBL967731 0.80 MGAM (0.55) MGAMGAASIMGAM2TDP1
SCHEMBL28297194 0.80 MGAM (0.55) MGAMGAASIMGAM2TDP1
SCHEMBL449524 0.79 MGAM (0.67) MGAMGAASIMGAM2TDP1
SCHEMBL28977030 0.78 LDHA (0.38) HSD17B10TSHR
SCHEMBL10320749 0.78 MGAM (0.52) MGAMGAASIMGAM2TDP1
SCHEMBL9287460 0.78 MGAM (0.52) MGAMGAASIMGAM2TDP1
SCHEMBL27276810 0.77
SCHEMBL727177 0.76 ALDH1A1 (0.50) MGAMGAASIMGAM2TDP1
SCHEMBL29163762 0.75 MGAM (0.55) MGAMGAASIMGAM2TDP1
SCHEMBL27963429 0.75 MGAM (0.55) MGAMGAASIMGAM2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106146410-B 6- amino -4 (3H)-Quinazol derivative and its preparation method and use 中南大学 2018-10-12 CN claimed
CN-105130914-B A kind of Cu2O‑Al2O3The method for catalyzing and synthesizing 1,2,3 triazole compounds 河南师范大学 2017-07-11 CN claimed
CN-106380469-A Synthesis method of 1-aromatic carbonyl-2-aryl-3-ester imidazolone compounds 河南师范大学 2017-02-08 CN claimed
CN-106078978-A A kind of processing method improving Lignum seu Ramulus Cunninghamiae Lanceolatae wood chip toughness 安徽信达家居有限公司 2016-11-09 CN claimed
CN-108358869-B A kind of N- benzothiazolyl benzsulfamide analog derivative, Preparation method and use 河北师范大学 2019-09-10 CN disclosed
CN-106083685-B A kind of preparation method of phenyl Piracetam 东北制药集团股份有限公司 2019-08-23 CN disclosed
CN-105859553-B A kind of preparation process of ethyl difluoro 南通宝凯化工有限公司 2019-05-21 CN disclosed
CN-109020812-A A kind of continuous uncatalyzed reaction prepares difluoro chloracetate and the chloroacetic method of difluoro 浙江省化工研究院有限公司 2018-12-18 CN disclosed
CN-108358869-A A kind of N- benzothiazolyls benzsulfamide analog derivative, Preparation method and use 河北师范大学 2018-08-03 CN disclosed
CN-108003026-A A kind of preparation process of ethyl difluoro 南通宝凯化工有限公司 2018-05-08 CN disclosed
CN-107686463-A A kind of chalcone aroyl acetyl amines, preparation method and applications 安徽中医药大学 2018-02-13 CN disclosed
CN-107200765-A A kind of Tauro ursodesoxy cholic acid synthetic method 广州市盈宇医药科技有限公司 2017-09-26 CN disclosed
CN-103183674-B One class fused heterocyclic derivative and its application 江苏先声药业有限公司 2017-09-12 CN disclosed
CN-106083685-A A kind of preparation method of phenyl piracetam 东北制药集团股份有限公司 2016-11-09 CN disclosed
CN-105859553-A Preparation technique of ethyl difluoroacetate 南通宝凯化工有限公司 2016-08-17 CN disclosed