SCHEMBL9312200

SCHEMBL9312200

O=C(O)c1cc(/C=C/c2ccc(S(=O)(=O)Nc3ccc(Cl)cn3)cc2)ccc1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A11 Q9UPY5 3/20 0.70
POLB P06746 1/20 0.54
PTPN1 P18031 3/20 0.51
PTPN2 P17706 1/20 0.51
PTPN6 P29350 1/20 0.51
ALDH1A1 P00352 3/20 0.50
BRD4 O60885 1/20 0.50
PKM P14618 1/20 0.50
TSHR P16473 2/20 0.48
MEN1 O00255 1/20 0.48
ABCC3 O15438 1/20 0.48
ABCC4 O15439 1/20 0.48
USP2 O75604 1/20 0.48
SLCO2B1 O94956 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
LMNA P02545 1/20 0.48
MMP1 P03956 1/20 0.48
ABCB1 P08183 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL8057896 1.00 SLC7A11 (0.70) SLC7A11POLBPTPN1PTPN2PTPN6
SCHEMBL8068378 0.87 SLC7A11 (0.70) SLC7A11PTPN1PTPN2PTPN6ALDH1A1
SCHEMBL8068375 0.87 SLC7A11 (0.70) SLC7A11PTPN1PTPN2PTPN6ALDH1A1
SCHEMBL8068591 0.83 SLC7A11 (0.70) SLC7A11POLBALDH1A1BRD4PKM
SCHEMBL8068359 0.83 SLC7A11 (1.00) SLC7A11POLBPTPN1PTPN2PTPN6
SCHEMBL8067761 0.83 SLC7A11 (1.00) SLC7A11POLBPTPN1PTPN2PTPN6
SCHEMBL8071847 0.82 SLC7A11 (0.75) SLC7A11POLBPTPN1PTPN2PTPN6
SCHEMBL8071849 0.82 SLC7A11 (0.75) SLC7A11POLBPTPN1PTPN2PTPN6
SCHEMBL8069115 0.77 SLC7A11 (0.66) SLC7A11PTPN1PTPN2PTPN6ALDH1A1
SCHEMBL8069117 0.77 SLC7A11 (0.66) SLC7A11PTPN1PTPN2PTPN6ALDH1A1

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
US-5302718-A Used for treating autoimmune diseases KABI PHARMACIA AB (SE) 1994-04-12 US disclosed