SCHEMBL6518219

SCHEMBL6518219

O=C(O)[C@@H](Cc1ccc(O)cc1)n1c(=O)c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.60
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
CYP2D6 P10635 1/20 0.54
SLC7A5 Q01650 1/20 0.53
HSD17B10 Q99714 2/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTPN7 P35236 1/20 0.51
RECQL P46063 1/20 0.51
BLM P54132 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ALDH1A1 P00352 2/20 0.46
PKM P14618 1/20 0.46
GAA P10253 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CA2 P00918 1/20 0.42

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
SCHEMBL2454105 0.85 POLB (0.69) POLBKMT2AMEN1TDP1SLC7A5
SCHEMBL5791501 0.85 POLB (0.69) POLBKMT2AMEN1TDP1SLC7A5
SCHEMBL592660 0.78 POLB (0.64) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL5010177 0.78 ALDH1A1 (0.77) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL112098 0.78 ALDH1A1 (0.77) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL17114021 0.77 POLB (0.71) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL6692611 0.76 POLB (1.00) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL11463170 0.76 POLB (1.00) POLBKMT2AMEN1TDP1CYP2D6
SCHEMBL1746215 0.75 MAPT (0.59) POLBKMT2AMEN1TDP1SLC7A5
SCHEMBL490650 0.74 SLC7A5 (0.67) POLBSLC7A5CA2CAMK2AESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050214894-A1 High throughput assay ISIS INNOVATION LIMITED (GB) 2005-09-29 US disclosed