SCHEMBL6906049

SCHEMBL6906049

CCS(=O)(=O)N(C)S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
CDK1 P06493 1/20 0.49
CYP1A2 P05177 1/20 0.49
MAPT P10636 3/20 0.45
TP53 P04637 1/20 0.45
GLA P06280 1/20 0.45
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL54922 0.87 GAA (0.58) GAACDK1CYP1A2MAPTTP53
SCHEMBL8347834 0.87 GAA (0.58) GAACDK1CYP1A2MAPTTP53
SCHEMBL8194115 0.86 GAA (0.55) GAACDK1CYP1A2MAPTTP53
SCHEMBL7157074 0.86 GAA (0.57) GAACDK1CYP1A2MAPTTP53
SCHEMBL2320176 0.86 GAA (0.57) GAACDK1CYP1A2MAPTTP53
SCHEMBL9785096 0.81 GAA (0.53) GAACDK1CYP1A2MAPTTP53
SCHEMBL9621633 0.80 GAA (0.51) GAACDK1CYP1A2MAPTALDH1A1
SCHEMBL8781441 0.80 GAA (0.51) GAACDK1CYP1A2MAPTTP53
SCHEMBL7800046 0.79 GAA (0.61) GAACDK1CYP1A2MAPTTP53
SCHEMBL8781452 0.79 GAA (0.55) GAACDK1CYP1A2MAPTTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5382564-A Synergistic mixture of benzoxazole compound and sulfonylurea HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-17 US claimed
EP-1414982-A2 DNA MOLECULES ENCODING HERBICIDE TOLERANT ACETOLACTATE SYNTHASE Syngenta Participations AG (CH) 2004-05-06 EP disclosed
WO-2003012115-A2 DNA MOLECULES ENCODING HERBICIDE TOLERANT ACETOLACTATE SYNTHASE SYNGENTA PARTICIPATIONS AG (CH) 2003-02-13 WO disclosed
US-6159900-A Synergistic herbicidal agents HOECHST AKTIENGESELLSCHAFT (DE) 2000-12-12 US disclosed