SCHEMBL27435510

SCHEMBL27435510

CCOC(=O)c1nncn1-c1c(Cl)ccc2nc(OC)c(OC)nc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 4/20 0.35
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
SIRT3 Q9NTG7 1/20 0.34
PDE2A O00408 1/20 0.34
PDE10A Q9Y233 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
NOTUM Q6P988 1/20 0.34
NPBWR1 P48145 1/20 0.34
MCHR1 Q99705 1/20 0.34
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
POLB P06746 1/20 0.33
GRM1 Q13255 1/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL7682046 0.87 POLB (0.37) DYRK1APDE2APDE10AALDH1A1MAPT
SCHEMBL27433674 0.82 MAPT (0.36) DYRK1ASIRT2SIRT1SIRT3PDE2A
SCHEMBL27413978 0.80 MEN1 (0.31) PDE10A
SCHEMBL27434412 0.78 PDE2A (0.44) PDE2APDE10AALDH1A1MAPTNPSR1
SCHEMBL27410461 0.75 ACHE (0.41) PDE2AALDH1A1MAPTNPSR1L3MBTL1
SCHEMBL7683018 0.71 POLB (0.40) DYRK1APDE2APDE10AALDH1A1MAPT
SCHEMBL27409634 0.71 PDE10A (0.37) PDE2APDE10AALDH1A1MAPTNPSR1
SCHEMBL7682502 0.69 PDE2A (0.43) SIRT2SIRT1PDE2APDE10AALDH1A1
SCHEMBL27413423 0.67 TLR8 (0.34) PDE2APDE10A
SCHEMBL7676180 0.66 ACHE (0.40) PDE2AALDH1A1MAPTNPSR1L3MBTL1

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
CN-1103770-C Quinoxalinediones PFIZER RES AND DEV CO N V S A (IE) 2003-03-26 CN disclosed
CN-1213369-A Quinoxalinedione compound PFIZER RES & DEV (IE) 1999-04-07 CN disclosed