SCHEMBL7464442

SCHEMBL7464442

Cc1cc2c(cc1-c1ccc(/C=C3\SC(=O)NC3=O)cc1O)C(C)(C)CCC2(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 1/20 0.51
PIM1 P11309 6/20 0.51
PIM2 Q9P1W9 6/20 0.51
GSK3B P49841 4/20 0.51
PIM3 Q86V86 3/20 0.51
CDC7 O00311 1/20 0.51
DAPK3 O43293 1/20 0.51
DYRK3 O43781 1/20 0.51
MAP4K4 O95819 1/20 0.51
PHKG2 P15735 1/20 0.51
RPS6KB1 P23443 1/20 0.51
CSNK1D P48730 1/20 0.51
CLK2 P49760 1/20 0.51
GSK3A P49840 1/20 0.51
NEK4 P51957 1/20 0.51
CSNK2A1 P68400 1/20 0.51
CSNK1G2 P78368 1/20 0.51
CAMK2D Q13557 1/20 0.51
DYRK1A Q13627 1/20 0.51
MINK1 Q8N4C8 1/20 0.51

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
SCHEMBL7464448 1.00 CISD1 (0.51) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL14492593 0.92 RXRA (0.59) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL5492185 0.92 RXRA (0.59) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL5492186 0.92 RXRA (0.59) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL7458010 0.92 PIM1 (0.52) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL7458015 0.92 PIM1 (0.52) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL5487591 0.90 PIM1 (0.52) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL14492757 0.90 PIM1 (0.52) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL5487590 0.90 PIM1 (0.52) CISD1PIM1PIM2GSK3BPIM3
SCHEMBL7462891 0.88 PIM1 (0.48) CISD1PIM1PIM2GSK3BPIM3

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