SCHEMBL12424797

SCHEMBL12424797

O=C1NC(c2ccc(-c3cccs3)cc2)=C2C(=O)NC(c3ccc(-c4cccs4)cc3)=C12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.51
SLC6A11 P48066 1/20 0.50
LTA4H P09960 1/20 0.46
LTK P29376 1/20 0.41
CDK5 Q00535 1/20 0.41
MST1R Q04912 1/20 0.41
DYRK1A Q13627 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
CYP17A1 P05093 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
KCNH2 Q12809 1/20 0.41
PRKCA P17252 1/20 0.40
PGR P06401 2/20 0.40
HDAC2 Q92769 1/20 0.40
ERN1 O75460 1/20 0.38
CYP2E1 P05181 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL14757441 0.86 SLC6A11 (0.41) GSK3BSLC6A11LTKCDK5MST1R
SCHEMBL167973 0.85 SLC6A11 (0.44) GSK3BSLC6A11LTKCDK5MST1R
SCHEMBL12424781 0.83 CYP2E1 (0.41) GSK3BSLC6A11LTKCDK5MST1R
SCHEMBL2397573 0.81 GSK3B (0.47) GSK3BSLC6A11LTKCDK5MST1R
SCHEMBL12219225 0.77 DPP4 (0.49) GSK3BSLC6A11LTA4HLTKCDK5
SCHEMBL15337183 0.77 DPP4 (0.49) GSK3BSLC6A11LTA4HLTKCDK5
SCHEMBL12946409 0.77 DPP4 (0.49) GSK3BSLC6A11LTA4HLTKCDK5
SCHEMBL16369828 0.77 GSK3B (0.56) GSK3BSLC6A11LTKCDK5MST1R
SCHEMBL12424815 0.76 MMP1 (0.33) GSK3BSLC6A11MAPTHPGDMAOA
SCHEMBL20464702 0.76 ABL1 (0.42) GSK3BSLC6A11LTA4HLTKCDK5

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
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-7977670-B2 Organic transistor TOYO INK MFG. CO., LTD. (JP) 2011-07-12 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed
US-20100032657-A1 ORGANIC TRANSISTOR TOYO INK MFG CO., LTD (JP) 2010-02-11 US disclosed