SCHEMBL6621602

SCHEMBL6621602

CCOc1c(C(=O)OC)nc(O)[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.40
RNASEH1 O60930 1/20 0.39
ERCC1 P07992 2/20 0.39
FEN1 P39748 2/20 0.39
ERCC4 Q92889 2/20 0.39
KDM4C Q9H3R0 1/20 0.35
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HSD17B10 Q99714 1/20 0.32
CNR2 P34972 1/20 0.32
GAA P10253 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL1668871 0.72 USP2 (0.53) RNASEH1ERCC1FEN1ERCC4KDM4C
SCHEMBL2491494 0.66 S1PR4 (0.48) NPSR1MAPTHSD17B10GAAMAPK1
SCHEMBL14602381 0.66 NPSR1 (0.42) NPSR1RNASEH1ERCC1FEN1ERCC4
SCHEMBL27275686 0.65 NPSR1 (0.41) NPSR1RNASEH1ERCC1FEN1ERCC4
SCHEMBL12844759 0.64 KLK7 (0.40) NPSR1ERCC1FEN1ERCC4
SCHEMBL13367230 0.63 LMNA (0.44) POLBMAPTHSD17B10CNR2GAA
SCHEMBL2153139 0.63 MAPT (0.50) KDM4CPOLBMAPTTDP1HSD17B10
SCHEMBL12697348 0.62 ERCC1 (0.57) NPSR1RNASEH1ERCC1FEN1ERCC4
SCHEMBL6094120 0.62 KDM4E (0.52) NPSR1POLBMAPTGAA
SCHEMBL7012111 0.62 NPSR1 (0.38) NPSR1RNASEH1KDM4CPOLBMAPT

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
EP-1470113-A1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2004-10-27 EP disclosed
WO-2003062211-A1 PYRIMIDINONE VIRAL POLYMERASE INHIBITORS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2003-07-31 WO disclosed