SCHEMBL3899893

SCHEMBL3899893

CC(=O)N(CC(=O)O)S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
KEAP1 Q14145 10/20 0.54
NFE2L2 Q16236 9/20 0.54
MAPK1 P28482 1/20 0.53
HSD11B1 P28845 2/20 0.50
MAPT P10636 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44

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
SCHEMBL25735706 0.89 KMT2A (0.56) KMT2AKEAP1NFE2L2MAPK1HSD11B1
SCHEMBL25702587 0.86 KMT2A (0.53) KMT2AKEAP1NFE2L2MAPK1HSD11B1
SCHEMBL25736043 0.85 KMT2A (0.56) KMT2AHSD11B1MAPTAPOBEC3G
SCHEMBL25735703 0.83 NR1I2 (0.54) KMT2AMAPK1HSD11B1MAPT
SCHEMBL25735699 0.82 KMT2A (0.53) KMT2AKEAP1NFE2L2MAPK1HSD11B1
SCHEMBL25712464 0.81 KMT2A (0.51) KMT2AKEAP1NFE2L2MAPK1HSD11B1
SCHEMBL3899542 0.80 KMT2A (0.47) KMT2AMAPK1HSD11B1MAPT
SCHEMBL25702589 0.80 RAB9A (0.51) KMT2AHSD11B1MAPTAPOBEC3G
SCHEMBL25735698 0.80 KMT2A (0.50) KMT2AKEAP1NFE2L2MAPK1HSD11B1
SCHEMBL25702584 0.80 KMT2A (0.50) KMT2AKEAP1NFE2L2MAPK1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1788429-B1 Method of making a lithographic printing plate AGFA GRAPHICS NV (BE) 2009-03-18 EP disclosed
WO-2007057346-A2 METHOD OF MAKING A LITHOGRAPHIC PRINTING PLATE AGFA GRAPHICS NV (BE) 2007-05-24 WO disclosed
EP-1788429-A1 Method of making a lithographic printing plate Agfa Graphics N.V. (BE) 2007-05-23 EP disclosed