SCHEMBL7467149

SCHEMBL7467149

CC(=O)Nc1cccc(CN2C(=O)CSC2=O)c1-c1cc2c(cc1C)C(C)(C)CCC2(C)C

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
ALDH1A1 P00352 4/20 0.39
PIM1 P11309 1/20 0.38
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
GAA P10253 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
RXRA P19793 3/20 0.35
RXRG P48443 2/20 0.35
RARA P10276 1/20 0.35
RXRB P28702 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RARG P13631 3/20 0.35
RARB P10826 2/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
CASP3 P42574 1/20 0.33

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
SCHEMBL7464451 0.86 PIM1 (0.44) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7458926 0.85 PIM1 (0.42) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7464136 0.85 PIM1 (0.44) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7470578 0.84 GSK3A (0.43) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7465316 0.84 ALDH1A1 (0.39) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7467696 0.83 PIM1 (0.42) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7461494 0.82 ALDH1A1 (0.43) TP53ALDH1A1GSK3AGSK3BGAA
SCHEMBL7458779 0.81 PIM1 (0.41) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7462919 0.81 PIM1 (0.41) TP53ALDH1A1PIM1GSK3AGSK3B
SCHEMBL7470549 0.81 PIM1 (0.42) ALDH1A1PIM1GSK3AGSK3BRXRA

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