SCHEMBL28703142

SCHEMBL28703142

[N-]=[N+]=C(Cc1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CES1 P23141 8/20 0.47
CES2 O00748 7/20 0.47
AKR1B1 P15121 1/20 0.47
EPHX2 P34913 1/20 0.43
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAPT P10636 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FNTA P49354 1/20 0.40
FNTB P49356 1/20 0.40
SRD5A2 P31213 2/20 0.40

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
SCHEMBL1473346 0.82 CES1 (0.52) CES1CES2AKR1B1EPHX2KMT2A
SCHEMBL8749069 0.79 CES1 (0.48) CES1CES2AKR1B1EPHX2KMT2A
SCHEMBL21758207 0.79 HIF1A (0.49) CES1CES2AKR1B1EPHX2KMT2A
SCHEMBL27587870 0.76 CES2 (0.45) CES1CES2KMT2AMEN1MAPT
SCHEMBL27849648 0.75 ALDH1A1 (0.44) CES1CES2AKR1B1EPHX2KMT2A
SCHEMBL8749208 0.75 KEAP1 (0.50) CES1CES2AKR1B1KMT2AMEN1
SCHEMBL28667928 0.75 CYP19A1 (0.46) CES1CES2AKR1B1KMT2AMEN1
SCHEMBL340540 0.74 CES2 (0.70) CES1CES2AKR1B1KMT2AMEN1
Benzil SCHEMBL8339350 0.74 CES2 (0.64) CES1CES2AKR1B1KMT2AMEN1
SCHEMBL13337400 0.74 ALDH1A1 (0.53) KMT2AMEN1HDAC8HDAC6MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213278-B Synthesis method of benzyl diazoacetophenone compound and benzyl diazoacetophenone compound 上海泰坦科技股份有限公司 2024-01-02 CN claimed
CN-114213278-A Synthesis method of benzyl diazo acetophenone compound and benzyl diazo acetophenone compound 上海泰坦科技股份有限公司 2022-03-22 CN claimed
CN-114213278-B Synthesis method of benzyl diazoacetophenone compound and benzyl diazoacetophenone compound 上海泰坦科技股份有限公司 2024-01-02 CN disclosed
CN-114213278-B Synthesis method of benzyl diazoacetophenone compound and benzyl diazoacetophenone compound 上海泰坦科技股份有限公司 2024-01-02 CN disclosed
CN-114213278-B Synthesis method of benzyl diazoacetophenone compound and benzyl diazoacetophenone compound 上海泰坦科技股份有限公司 2024-01-02 CN disclosed
CN-114213278-A Synthesis method of benzyl diazo acetophenone compound and benzyl diazo acetophenone compound 上海泰坦科技股份有限公司 2022-03-22 CN disclosed
CN-114213278-A Synthesis method of benzyl diazo acetophenone compound and benzyl diazo acetophenone compound 上海泰坦科技股份有限公司 2022-03-22 CN disclosed
CN-114213278-A Synthesis method of benzyl diazo acetophenone compound and benzyl diazo acetophenone compound 上海泰坦科技股份有限公司 2022-03-22 CN disclosed