SCHEMBL31236662

SCHEMBL31236662

CC(=O)Oc1c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c2c1=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLH Q9Y253 8/20 0.76
KDM4E B2RXH2 5/20 0.76
MEN1 O00255 4/20 0.76
KMT2A Q03164 4/20 0.76
POLB P06746 4/20 0.76
RECQL P46063 4/20 0.76
GAA P10253 3/20 0.76
HSD17B10 Q99714 3/20 0.76
APEX1 P27695 3/20 0.76
MMP1 P03956 2/20 0.76
MAPT P10636 2/20 0.76
BLM P54132 2/20 0.76
HTT P42858 1/20 0.76
EPHX2 P34913 2/20 0.72
SRC P12931 5/20 0.66
CYP3A4 P08684 3/20 0.65
NOX4 Q9NPH5 2/20 0.65
USP2 O75604 2/20 0.65
TP53 P04637 2/20 0.65
CYP1A2 P05177 2/20 0.65

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
SCHEMBL4175201 1.00 POLH (0.76) POLHKDM4EMEN1KMT2APOLB
SCHEMBL4160544 0.90 CYP3A4 (0.75) POLHKDM4EMEN1KMT2APOLB
SCHEMBL30627918 0.90 CYP3A4 (0.75) POLHKDM4EMEN1KMT2APOLB
SCHEMBL30627917 0.90 CYP3A4 (0.75) POLHKDM4EMEN1KMT2APOLB
SCHEMBL11298140 0.89 POLH (0.70) POLHKDM4EMEN1KMT2APOLB
SCHEMBL30627915 0.89 TUBB4A (0.81) POLHKDM4EMEN1KMT2APOLB
SCHEMBL7940707 0.88 EPHX2 (0.72) POLHKDM4EMEN1KMT2APOLB
SCHEMBL4170634 0.87 POLH (0.74) POLHKDM4EMEN1KMT2APOLB
SCHEMBL15928808 0.87 POLH (0.71) POLHKDM4EMEN1KMT2APOLB
SCHEMBL4157325 0.87 ABCB1 (0.76) POLHKDM4EMEN1KMT2APOLB

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
CN-110831589-B Medical compounds 维拉萨卢斯里切尔卡有限公司 2025-01-03 CN disclosed