SCHEMBL30928908

SCHEMBL30928908

CC(C)c1nn(Cc2ccccc2)c(=O)n(Cc2ccc(C(=O)O)cc2)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 6/20 0.46
KMT2A Q03164 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 1/20 0.46
USP2 O75604 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.46
NR4A1 P22736 1/20 0.46
APEX1 P27695 1/20 0.46
APOBEC3A P31941 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HIF1A Q16665 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
IDO1 P14902 1/20 0.46

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
SCHEMBL30928896 0.90 TDP1 (0.52) KMT2ATDP1MEN1ALDH1A1RECQL
SCHEMBL30928917 0.81 GRN (0.47) PTGER4KMT2ATDP1MEN1POLB
SCHEMBL30928900 0.80 ALDH1A1 (0.52) PTGER4KMT2ATDP1MEN1POLB
SCHEMBL30928928 0.74 GCGR (0.46) PTGER4KMT2AALDH1A1SMN1; SMN2IDO1
SCHEMBL30928893 0.73 PDE1A (0.42) PTGER4KMT2ATDP1MEN1POLB
SCHEMBL1007634 0.72 PTGER4 (0.44) PTGER4KMT2ATDP1MEN1POLB
SCHEMBL7821971 0.71 KDM4E (0.53) KMT2AMEN1POLBKDM4EALDH1A1
SCHEMBL31122794 0.71 KMT2A (0.42) KMT2AMEN1POLBALDH1A1
SCHEMBL30928907 0.70 ALDH1A1 (0.49) KMT2ATDP1MEN1USP2ALDH1A1
SCHEMBL3556560 0.68 HDAC1 (0.67) THRBMMP13SLC22A8HDAC1HDAC11

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-118184594-A Preparation method of aza-uracil compound, and compound prepared by same and application of aza-uracil compound 杭州医学院 2024-06-14 CN disclosed