SCHEMBL28028822

SCHEMBL28028822

O=S(=O)(Cc1ccccc1)Nc1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.62
RECQL P46063 1/20 0.58
KEAP1 Q14145 1/20 0.57
PARP14 Q460N5 1/20 0.56
ALDH1A1 P00352 4/20 0.53
KDM4E B2RXH2 3/20 0.53
HPGD P15428 2/20 0.53
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
MAPT P10636 1/20 0.51
GSK3B P49841 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP8 P22894 1/20 0.49
MMP13 P45452 1/20 0.49
ACLY P53396 1/20 0.47

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
SCHEMBL2128507 0.81 KEAP1 (0.68) RECQLKEAP1PARP14ALDH1A1KDM4E
SCHEMBL3983370 0.79 METAP2 (0.64) GLO1PARP14ALDH1A1KDM4EHPGD
SCHEMBL17186105 0.78 GLO1 (0.53) GLO1RECQLPARP14ALDH1A1KDM4E
SCHEMBL11640095 0.78 EP300 (0.59) PARP14ALDH1A1HPGDKMT2AMEN1
SCHEMBL30372036 0.77 GLO1 (1.00) GLO1KMT2AMEN1
SCHEMBL6982956 0.77 GLO1 (1.00) GLO1KMT2AMEN1
SCHEMBL10808948 0.77 KEAP1 (0.57) GLO1RECQLKEAP1ALDH1A1KDM4E
SCHEMBL10780391 0.76 KEAP1 (0.71) RECQLKEAP1ALDH1A1KDM4EHPGD
SCHEMBL6005274 0.76 KEAP1 (0.71) RECQLKEAP1ALDH1A1KDM4EHPGD
SCHEMBL7898382 0.76 GLO1 (0.54) GLO1PARP14ALDH1A1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104969406-B Electrolyte solution for electrochemical device and electrochemical device 富士胶片和光纯药株式会社 2018-11-02 CN disclosed
CN-104969406-A Electrolyte solution for electrochemical device and electrochemical device WAKO PURE CHEM IND LTD 2015-10-07 CN disclosed