SCHEMBL4664206

SCHEMBL4664206

COc1ccc(NC(=O)[C@@](C)(N)CO)cc1NS(=O)(=O)c1ccc(-c2ccc(C)o2)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.43
KDM4E B2RXH2 4/20 0.43
GHSR Q92847 7/20 0.43
POLB P06746 2/20 0.43
MAPK1 P28482 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KMT2A Q03164 6/20 0.41
LMNA P02545 4/20 0.41
MEN1 O00255 3/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 2/20 0.41
USP2 O75604 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NAMPT P43490 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL13245970 1.00 ALDH1A1 (0.43) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL13245951 0.92 ALDH1A1 (0.46) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL13245972 0.88 ALDH1A1 (0.45) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL2983496 0.87 ALDH1A1 (0.47) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL2986828 0.86 ALDH1A1 (0.42) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL4664203 0.86 GHSR (0.44) ALDH1A1KDM4EGHSRMAPK1SMN1; SMN2
SCHEMBL13245956 0.86 ALDH1A1 (0.50) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL4664054 0.85 KDM4E (0.45) ALDH1A1KDM4EGHSRMAPK1SMN1; SMN2
SCHEMBL13245969 0.85 AAK1 (0.47) ALDH1A1KDM4EGHSRPOLBMAPK1
SCHEMBL13245955 0.84 KMT2A (0.46) ALDH1A1KDM4EGHSRPOLBMAPK1

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-2007716-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2008-12-31 EP disclosed
WO-2007118852-A1 ARYL AND HETEROARYL SULPHONAMIDES AS GROWTH HORMONE SECRETAGOGUE RECEPTOR AGONISTS GLAXO GROUP LIMITED (GB) 2007-10-25 WO disclosed