SCHEMBL3671511

SCHEMBL3671511

COc1ccccc1C1=C(C)C(=O)NC1=O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 6/20 0.66
STK10 O94804 18/20 0.64
SLK Q9H2G2 18/20 0.64
GSK3A P49840 3/20 0.58
CLK2 P49760 1/20 0.57
STK33 Q9BYT3 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57
TLK1 Q9UKI8 1/20 0.57

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
SCHEMBL19583334 0.83 GSK3B (0.54) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL3680066 0.82 STK10 (0.53) GSK3BSTK10SLK
SCHEMBL3823447 0.81 STK10 (0.66) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL9042282 0.79 GSK3B (0.56) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL3675474 0.78 GSK3B (0.48) GSK3BSTK10SLK
SCHEMBL18049413 0.78 STK10 (0.62) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL9204436 0.74 STK10 (0.43) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL9200511 0.74 STK10 (0.43) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL9339235 0.72 STK10 (0.56) GSK3BSTK10SLKGSK3ACLK2
SCHEMBL8890003 0.71 MYC (0.49) GSK3BGSK3A

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