SCHEMBL7555602

SCHEMBL7555602

CS(=O)(=O)c1cc2c(cc1-c1ccc(CN3C(=O)CSC3=O)cc1Cl)C(S(C)(=O)=O)(S(C)(=O)=O)CCC2(S(C)(=O)=O)S(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
GSK3A P49840 3/20 0.40
GSK3B P49841 3/20 0.40
KMT2A Q03164 2/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KCNN4 O15554 4/20 0.36
MET P08581 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
AXL P30530 1/20 0.33
PPARG P37231 1/20 0.33
ADRA1D P25100 1/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL7521133 0.90 POLB (0.42) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL7517515 0.77 PIM1 (0.39) POLBGSK3AGSK3BALDH1A1PIM1
SCHEMBL7522730 0.76 POLB (0.34) POLBGSK3AGSK3BKMT2AALDH1A1
SCHEMBL7464561 0.75 GSK3A (0.47) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL7459796 0.72 POLB (0.45) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL5460030 0.70 KMT2A (0.72) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL7252535 0.67 GSK3A (0.82) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL7460353 0.66 GSK3A (0.48) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL5454906 0.65 GSK3A (0.72) POLBGSK3AGSK3BKMT2AHDAC1
SCHEMBL7463442 0.64 ALDH1A1 (0.46) POLBGSK3AGSK3BHDAC1HDAC6

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