SCHEMBL7630786

SCHEMBL7630786

O=Nc1cc(S(=O)(=O)O)c2cccnc2c1O.[Na]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.66
HIF1A Q16665 2/20 0.66
HPGD P15428 1/20 0.66
PTPN11 Q06124 3/20 0.64
PTPN7 P35236 2/20 0.64
ALOX15 P16050 2/20 0.64
HSD17B10 Q99714 2/20 0.64
PTPRC P08575 1/20 0.64
PTPN1 P18031 1/20 0.64
PTPN6 P29350 1/20 0.64
PTPRJ Q12913 1/20 0.64
DUSP26 Q9BV47 1/20 0.64
COMT P21964 8/20 0.55
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 1/20 0.49
XBP1 P17861 1/20 0.49
RAB9A P51151 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL7630773 0.97 CYP1A2 (0.66) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL7630777 0.85 PTPN11 (0.65) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL9017568 0.82 CYP1A2 (0.75) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL4461500 0.82 COMT (0.64) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL2981945 0.81 COMT (0.66) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL17552280 0.81 CYP1A2 (0.80) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL13921609 0.81 CYP1A2 (0.84) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL13921616 0.81 CYP1A2 (0.80) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL13936089 0.81 CYP1A2 (0.73) CYP1A2HIF1AHPGDPTPN11PTPN7
SCHEMBL8072742 0.81 CYP1A2 (0.77) CYP1A2HIF1AHPGDPTPN11PTPN7

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-2002051415-A2 USE OF SEQUESTRANTS FOR TREATING PRION DISEASES XILINAS MICHEL (CY) 2002-07-04 WO disclosed