SCHEMBL9739119

SCHEMBL9739119

COc1cc(C)nc(NC(=O)NS(=O)(=O)c2ccccc2C(O)C(C)F)n1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.49
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CDK1 P06493 1/20 0.42
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
HTT P42858 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
SCHEMBL8098891 0.94 GAA (0.55) GAACDK1MAPTKDM4ENPC1
SCHEMBL9126935 0.87 GAA (0.56) GAACDK1MAPTKDM4ENPC1
SCHEMBL9127057 0.86 TSHR (0.50) GAATSHRSMN1; SMN2CDK1MAPT
SCHEMBL10642716 0.86 GAA (0.50) GAATSHRSMN1; SMN2CDK1MAPT
SCHEMBL7452294 0.86 GAA (0.47) GAATSHRSMN1; SMN2CDK1MAPT
SCHEMBL9127660 0.84 GAA (0.53) GAACDK1MAPTKDM4ENPC1
SCHEMBL11130838 0.84 GAA (0.57) GAACDK1MAPTKDM4ENPC1
SCHEMBL7806542 0.83 GAA (0.53) GAACDK1MAPTKDM4ENPC1
SCHEMBL10569768 0.83 GAA (0.51) GAATSHRSMN1; SMN2CDK1MAPT
SCHEMBL27535143 0.83 GAA (0.40) GAACDK1MAPTTP53GLA

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
WO-1992015568-A1 BENZENESULFONYLUREA DERIVATIVES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1992-09-17 WO claimed