SCHEMBL2210459

SCHEMBL2210459

COc1cc(OC)c(/C=C/S(=O)(=O)Nc2ccc(OC)c(NC(=O)c3ccccc3)c2)c(OC)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
ALDH1A1 P00352 6/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 3/20 0.51
HDAC1 Q13547 2/20 0.50
HDAC8 Q9BY41 2/20 0.50
HDAC6 Q9UBN7 2/20 0.50
HTT P42858 3/20 0.48
MAPT P10636 3/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HPGD P15428 1/20 0.46
HDAC3 O15379 1/20 0.46

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
SCHEMBL2210509 1.00 KMT2A (0.53) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2213353 0.90 MAPT (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2212729 0.90 MAPT (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2209649 0.88 TSHR (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2210376 0.88 TSHR (0.46) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2213268 0.87 PLK1 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2HDAC1
SCHEMBL2213252 0.87 PLK1 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2HDAC1
SCHEMBL2212730 0.87 MEN1 (0.56) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL2212726 0.87 MEN1 (0.56) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL2210291 0.86 PLK1 (0.49) KMT2AMEN1ALDH1A1SMN1; SMN2KDM4E

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
EP-1534284-B1 AMINO-SUBSTITUTED SULFONANILIDES AND DERIVATIVES THEREOF FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2011-07-27 EP claimed
EP-1534284-B1 AMINO-SUBSTITUTED SULFONANILIDES AND DERIVATIVES THEREOF FOR TREATING PROLIFERATIVE DISORDERS UNIV TEMPLE (US) 2011-07-27 EP disclosed