SCHEMBL8809369

SCHEMBL8809369

COc1cccc(Cn2ccc3c(C=C4NC(=O)SC4=O)cccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
PARP1 P09874 5/20 0.44
CSNK2A2 P19784 1/20 0.44
CLK1 P49759 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
DYRK1A Q13627 1/20 0.44
DYRK2 Q92630 1/20 0.44
DYRK1B Q9Y463 1/20 0.44
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
ABCC2 Q92887 1/20 0.42
LPO P22079 3/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41

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
SCHEMBL8810078 0.93 CSNK2A2 (0.45) SLC2A1PARP1CSNK2A2CLK1CSNK2B
SCHEMBL8808802 0.90 CSNK2A2 (0.51) PARP1CSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL8809361 0.89 PARP1 (0.58) SLC2A1PARP1PIM1AKR1B1PIM2
SCHEMBL8810641 0.89 PARP1 (0.58) PARP1CSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL8685971 0.89 PARP1 (0.58) SLC2A1PARP1PIM1AKR1B1PIM2
SCHEMBL8810812 0.88 PARP1 (0.42) PARP1CSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL8809171 0.87 PARP1 (0.48) SLC2A1PARP1MAPTLMNATP53
SCHEMBL8813170 0.86 CSNK2A2 (0.44) PARP1CSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL8814237 0.86 CSNK2A2 (0.44) PARP1CSNK2A2CLK1CSNK2BCSNK2A1
SCHEMBL8685967 0.86 PARP1 (0.50) PARP1MAPTLMNAPOLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780389-A1 Thiazolidinedione derivatives, process for their preparation and pharmaceutical compositions containing them TOBISHI PHARMACEUTICAL CO., LTD. (JP) 1997-06-25 EP disclosed