SCHEMBL6025440

SCHEMBL6025440

Cc1ccc(S(=O)(=O)ON=C(C(=O)O)c2ccc(F)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
MEN1 O00255 2/20 0.46
PAX8 Q06710 1/20 0.46
CYP1A2 P05177 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TAS2R14 Q9NYV8 1/20 0.44
TP53 P04637 2/20 0.43
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
STAT3 P40763 1/20 0.40
PTGS2 P35354 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39

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
SCHEMBL6025438 1.00 KMT2A (0.49) KMT2AGAAL3MBTL1MEN1PAX8
SCHEMBL6025245 0.93 STAT3 (0.44) KMT2AGAAL3MBTL1MEN1SMN1; SMN2
SCHEMBL6025244 0.93 STAT3 (0.44) KMT2AGAAL3MBTL1MEN1SMN1; SMN2
SCHEMBL6024583 0.87 RECQL (0.47) KMT2AMEN1TP53ALDH1A1MAPT
SCHEMBL6024585 0.87 RECQL (0.47) KMT2AMEN1TP53ALDH1A1MAPT
SCHEMBL6025371 0.85 ALDH1A1 (0.50) KMT2AGAAMEN1CYP1A2SMN1; SMN2
SCHEMBL6025374 0.85 ALDH1A1 (0.50) KMT2AGAAMEN1CYP1A2SMN1; SMN2
SCHEMBL6025643 0.85 KMT2A (0.46) KMT2AGAAL3MBTL1MEN1PAX8
SCHEMBL6025112 0.85 KMT2A (0.46) KMT2AGAAL3MBTL1MEN1PAX8
SCHEMBL6024807 0.84 ALDH1A1 (0.45) KMT2AGAAMEN1SMN1; SMN2TAS2R14

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
EP-1163553-B1 OXIME DERIVATIVES AND THE USE THEREOF AS PHOTOINITIATORS CIBA SC HOLDING AG (CH) 2006-06-14 EP claimed