SCHEMBL12424892

SCHEMBL12424892

O=C1NC(c2ccc(F)c(F)c2F)=C2C(=O)NC(c3ccc(F)c(F)c3F)=C12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.35
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
TDP2 O95551 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
DAPK3 O43293 1/20 0.32
NTRK1 P04629 1/20 0.32
PIM1 P11309 1/20 0.32
FLT3 P36888 1/20 0.32
GSK3B P49841 1/20 0.32
ROCK1 Q13464 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
PPOX P50336 1/20 0.31
CDK2 P24941 1/20 0.30
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL12424870 0.82 CA1 (0.38) PDE3BPDE3ACES2CES1GSK3B
SCHEMBL12424914 0.80 TGM2 (0.32) GRM5PPOX
SCHEMBL12425018 0.78 DAO (0.31) CES2CES1DAO
SCHEMBL12424871 0.74 TDP2 (0.46) GRM5PDE3BPDE3ATDP2FLT3
SCHEMBL12424872 0.74 CA9 (0.40) GRM5PDE3BPDE3ATDP2CES2
SCHEMBL12424862 0.73 GSK3B (0.44) GSK3B
SCHEMBL12424887 0.73 PPOX (0.50) TDP2CES1DAPK3PIM1GSK3B
SCHEMBL12424972 0.73 TGM2 (0.46) GRM5TDP2CES1DAPK3NTRK1
SCHEMBL12424937 0.72 TDP2 (0.41) TDP2CES1
SCHEMBL12424869 0.72 NISCH (0.41) DAPK3NTRK1PIM1FLT3GSK3B

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