SCHEMBL7521133

SCHEMBL7521133

Cc1cc(CN2C(=O)CSC2=O)ccc1-c1cc2c(cc1S(C)(=O)=O)C(S(C)(=O)=O)(S(C)(=O)=O)CCC2(S(C)(=O)=O)S(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
GSK3A P49840 3/20 0.39
GSK3B P49841 3/20 0.39
ALDH1A1 P00352 4/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PPARG P37231 1/20 0.33
MET P08581 1/20 0.32
FGFR1 P11362 1/20 0.32
FGFR2 P21802 1/20 0.32
FGFR3 P22607 1/20 0.32
AXL P30530 1/20 0.32
PIM1 P11309 1/20 0.32
KCNN4 O15554 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
KMT2A Q03164 3/20 0.31
TP53 P04637 2/20 0.31

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
SCHEMBL7555602 0.90 POLB (0.44) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7517515 0.81 PIM1 (0.39) POLBGSK3AGSK3BALDH1A1PIM1
SCHEMBL7460353 0.77 GSK3A (0.48) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7522730 0.77 POLB (0.34) POLBGSK3AGSK3BALDH1A1PIM1
SCHEMBL7458454 0.72 POLB (0.43) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7464315 0.71 GSK3A (0.45) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7463442 0.71 ALDH1A1 (0.46) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7461714 0.70 GSK3A (0.44) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7464561 0.70 GSK3A (0.47) POLBGSK3AGSK3BALDH1A1HDAC1
SCHEMBL7457132 0.69 GSK3A (0.41) POLBGSK3AGSK3BALDH1A1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1214305-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION Maxia Pharmaceuticals, Inc. (US) 2002-06-19 EP disclosed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO disclosed