SCHEMBL7460972

SCHEMBL7460972

CCc1cccc(CN2C(=O)CSC2=O)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 2/20 0.67
GSK3B P49841 2/20 0.67
ALDH1A1 P00352 3/20 0.64
POLB P06746 1/20 0.55
PIM1 P11309 1/20 0.49
GFER P55789 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
PPARG P37231 1/20 0.46
KCNN4 O15554 9/20 0.46
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
RECQL P46063 1/20 0.42

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
SCHEMBL7462946 0.85 GSK3A (0.67) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL5455026 0.82 GSK3A (0.67) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL5782807 0.82 GSK3A (0.67) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL5455104 0.82 GSK3A (0.71) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL29411719 0.82 ALDH1A1 (0.68) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL5461421 0.81 KCNN4 (0.65) GSK3AGSK3BALDH1A1POLBKCNN4
SCHEMBL7463278 0.81 GSK3A (0.61) GSK3AGSK3BALDH1A1POLBPIM1
Hydrochloric Acid SCHEMBL5460366 0.81 GSK3A (0.65) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL338442 0.80 GSK3A (1.00) GSK3AGSK3BALDH1A1POLBPIM1
SCHEMBL1200938 0.78 ALDH1A1 (1.00) GSK3AGSK3BALDH1A1POLBHDAC1

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 4 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 claimed
WO-2001016123-A1 BENZYLIDENE-THIAZOLIDINEDIONES AND ANALOGUES AND THEIR USE IN THE TREATMENT OF INFLAMMATION MAXIA PHARMACEUTICALS, INC. (US) 2001-03-08 WO claimed
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