SCHEMBL7630773

SCHEMBL7630773

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

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 0.61
▸ ALOX15 P16050 2/20 0.61
▸ HSD17B10 Q99714 2/20 0.61
▸ PTPN7 P35236 2/20 0.61
▸ PTPRC P08575 1/20 0.61
▸ PTPN1 P18031 1/20 0.61
▸ PTPN6 P29350 1/20 0.61
▸ PTPRJ Q12913 1/20 0.61
▸ DUSP26 Q9BV47 1/20 0.61
▸ COMT P21964 6/20 0.55
▸ ALDH1A1 P00352 2/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ TDP1 Q9NUW8 2/20 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

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
SCHEMBL7630786 0.97 CYP1A2 (0.66) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL7630777 0.85 PTPN11 (0.65) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL4461500 0.82 COMT (0.64) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL28442201 0.81 CYP1A2 (0.98) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL2981945 0.81 COMT (0.66) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL13921609 0.81 CYP1A2 (0.84) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL13936089 0.81 CYP1A2 (0.73) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL13921616 0.81 CYP1A2 (0.80) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL17552280 0.81 CYP1A2 (0.80) CYP1A2HIF1AHPGDPTPN11ALOX15
SCHEMBL8072742 0.81 CYP1A2 (0.77) CYP1A2HIF1AHPGDPTPN11ALOX15

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
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