SCHEMBL28972732

SCHEMBL28972732

CCOC(=O)CCC(OC)C(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
KMT2A Q03164 2/20 0.49
POLB P06746 2/20 0.49
CYP1A2 P05177 1/20 0.44
GAA P10253 2/20 0.43
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
ALDH1A1 P00352 8/20 0.40
TRPA1 O75762 1/20 0.40
HSD17B10 Q99714 4/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39
CYP3A4 P08684 3/20 0.38
ALOX15 P16050 3/20 0.38
TSHR P16473 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 0.37
CHRM1 P11229 1/20 0.37

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
SCHEMBL28972736 0.84 L3MBTL1 (0.51) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL14464925 0.82 ALOX15 (0.41) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL21891763 0.82 L3MBTL1 (0.46) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL8209757 0.81 ALDH1A1 (0.40) L3MBTL1KMT2APOLBGAAMGAM
SCHEMBL1245715 0.79 ALDH1A1 (0.50) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL8265723 0.79 L3MBTL1 (0.50) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL27604409 0.78 CPB2 (0.43) L3MBTL1POLBCYP1A2GAAMGAM
SCHEMBL27611789 0.78 CA2 (0.47) KMT2APOLBGAAMGAMSI
SCHEMBL31182141 0.78 L3MBTL1 (0.49) L3MBTL1KMT2APOLBCYP1A2GAA
SCHEMBL27748153 0.77 L3MBTL1 (0.49) L3MBTL1KMT2APOLBCYP1A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN claimed
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN disclosed
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN disclosed
CN-115677491-A Preparation process of ethyl 4- (ethoxycarbonyl) methoxybutyrate 武汉市振邦生物科技有限公司 2023-02-03 CN disclosed