SCHEMBL3669622

SCHEMBL3669622

COc1cccc(C2=C(C)C(=O)NC2=O)c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 12/20 0.60
STK10 O94804 4/20 0.60
SLK Q9H2G2 4/20 0.60
PRKCA P17252 4/20 0.54
GSK3A P49840 1/20 0.52
NEK2 P51955 1/20 0.52
GAA P10253 1/20 0.50
CHEK1 O14757 1/20 0.49
ALKBH3 Q96Q83 1/20 0.48
HDAC4 P56524 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
PIK3CG P48736 1/20 0.47
PGR P06401 1/20 0.47

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
SCHEMBL23291867 0.87 GSK3B (0.47) GSK3BSTK10SLKPRKCAGSK3A
SCHEMBL23291850 0.86 MAOA (0.47) GSK3BSTK10SLKPRKCAGSK3A
SCHEMBL4789169 0.85 GSK3B (0.62) GSK3BSTK10SLKPRKCAGSK3A
SCHEMBL28527835 0.84 MAOA (0.50) GSK3BSTK10SLKPRKCAGSK3A
SCHEMBL7132790 0.84 PTGS2 (0.44) GSK3BSTK10SLKGSK3A
SCHEMBL5892139 0.80 GAA (0.53) GSK3BSTK10SLKPRKCAGAA
SCHEMBL3729848 0.80 CAMK2D (0.44) GSK3BPRKCAPGR
SCHEMBL3677953 0.80 GSK3B (0.60) GSK3BSTK10SLKGSK3A
SCHEMBL4079370 0.77 GSK3B (0.57) GSK3BSTK10SLKGSK3APGR
SCHEMBL28785378 0.77 GSK3B (0.54) GSK3BSTK10SLKGSK3APIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7825188-B2 Thermoplastic elastomer with acyloxyphenyl hard block segment DESIGNER MOLECULES, INC. (US) 2010-11-02 US claimed
WO-2008077141-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-06-26 WO claimed
US-20080146738-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. 2008-06-19 US claimed
US-7825188-B2 Thermoplastic elastomer with acyloxyphenyl hard block segment DESIGNER MOLECULES, INC. (US) 2010-11-02 US disclosed
WO-2008077141-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. (US) 2008-06-26 WO disclosed
US-20080146738-A1 RUBBER EPOXY CURATIVES AND METHODS FOR USE THEREOF DESIGNER MOLECULES, INC. 2008-06-19 US disclosed