SCHEMBL2397573

SCHEMBL2397573

O=C1NC2=C(c3cccs3)C(=O)NC2=C1c1cccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 0.47
PRKCA P17252 1/20 0.47
SLC6A11 P48066 1/20 0.44
LTK P29376 1/20 0.42
CDK5 Q00535 1/20 0.42
MST1R Q04912 1/20 0.42
DYRK1A Q13627 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
CAMK2D Q13557 1/20 0.40
MAOA P21397 2/20 0.40
TYMP P19971 1/20 0.40
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL167973 0.88 SLC6A11 (0.44) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL16369828 0.87 GSK3B (0.56) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL20464702 0.85 ABL1 (0.42) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL12313771 0.82 GSK3B (0.36) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL12424797 0.81 GSK3B (0.51) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL12946409 0.80 DPP4 (0.49) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL12219225 0.80 DPP4 (0.49) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL15337183 0.80 DPP4 (0.49) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL2457911 0.79 GSK3B (0.39) GSK3BPRKCASLC6A11LTKCDK5
SCHEMBL14757441 0.78 SLC6A11 (0.41) GSK3BPRKCASLC6A11LTKCDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2550688-B1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC (TW) 2016-10-26 EP disclosed
EP-2550688-B1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC (TW) 2016-10-26 EP disclosed
US-8598448-B2 Pyrrolo[3,2-B]pyrrole semiconducting compounds and devices incorporating same POLYERA CORPORATION (US) 2013-12-03 US disclosed
WO-2011119446-A1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME POLYERA CORPORATION (US) 2011-09-29 WO disclosed
US-20110226338-A1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC. (TW) 2011-09-22 US disclosed
US-20110226338-A1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC. (TW) 2011-09-22 US disclosed
US-20110226338-A1 PYRROLO[3,2-B]PYRROLE SEMICONDUCTING COMPOUNDS AND DEVICES INCORPORATING SAME RAYNERGY TEK INC. (TW) 2011-09-22 US disclosed