SCHEMBL6821768

SCHEMBL6821768

NC(=O)n1c(N)nc2[nH]cnc2c1=O

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GDA Q9Y2T3 1/20 0.39
PARP1 P09874 2/20 0.33
PNP P00491 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL2940012 0.86 KDM4E (0.46) GDAPARP1PNPKDM4EMEN1
SCHEMBL218666 0.86 GDA (0.34) GDAPARP1PNPPDE4APDE4B
Bromide SCHEMBL8165610 0.85 GDA (0.33) GDAPNPPDE4APDE4BPDE4C
SCHEMBL453202 0.82 GDA (0.32) GDA
SCHEMBL8843867 0.80 PDE4A (0.38) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL5694185 0.80 NPC1 (0.51) PNPKDM4EMEN1POLBKMT2A
SCHEMBL3072977 0.79 MGMT (0.32) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL20576 0.79 PNP (0.34) GDAPARP1PNPPDE4APDE4B
SCHEMBL2983845 0.79 PNP (0.34) GDAPARP1PNPPDE4APDE4B
SCHEMBL1740456 0.77 ALDH1A1 (0.36) PNPPDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040209352-A1 Integrated electrode and cell immobilization device equipped with the integrated electrode MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD (JP) 2004-10-21 US claimed
US-20040209352-A1 Integrated electrode and cell immobilization device equipped with the integrated electrode MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD (JP) 2004-10-21 US disclosed