SCHEMBL28632556

SCHEMBL28632556

CN(CCO)S(=O)(=O)CC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MMP3 P08254 3/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PHF8 Q9UPP1 1/20 0.31
KDM2A Q9Y2K7 1/20 0.31
GSTO1 P78417 1/20 0.31

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
SCHEMBL28637720 0.79 POLB (0.36) POLBMMP3
SCHEMBL22345325 0.78 MEN1 (0.39) MMP3ALDH1A1KDM4EKMT2AMEN1
SCHEMBL7198490 0.77 MAPT (0.41) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL28632597 0.75 KDM4E (0.39) POLBMMP3ALDH1A1KDM4E
SCHEMBL4248401 0.74 POLB (0.48) POLBPHF8KDM2A
SCHEMBL796093 0.69
SCHEMBL13386680 0.68 MAPT (0.38) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL17323652 0.68 POLB (0.42) POLB
SCHEMBL9466919 0.68 CNR2 (0.36) POLBALDH1A1KMT2AMEN1MAPT
SCHEMBL15135141 0.68 ALDH1A1 (0.36) ALDH1A1KDM4EKMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113439081-A Pyridazinium compounds for use in methods of controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-24 CN disclosed