SCHEMBL30947792

SCHEMBL30947792

COc1cc(C(=O)OCCOCCOC(=O)c2ccc(O)c(OC)c2)ccc1O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.78
POLB P06746 1/20 0.78
HDAC6 Q9UBN7 1/20 0.78
HSD17B2 P37059 1/20 0.72
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
SMN1; SMN2 Q16637 1/20 0.61
SLC22A6 Q4U2R8 1/20 0.60
SLC22A8 Q8TCC7 1/20 0.60
RAB9A P51151 1/20 0.60
HTT P42858 1/20 0.58
SERPINE1 P05121 1/20 0.54
CYP1A2 P05177 1/20 0.54
HSP90AA1 P07900 1/20 0.54
HSP90AB1 P08238 1/20 0.54
BLM P54132 1/20 0.54
MAPT P10636 1/20 0.51
TSHR P16473 1/20 0.51
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL25421686 1.00 KDM4E (0.78) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL25668836 1.00 KDM4E (0.78) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL1356516 0.95 KDM4E (0.85) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL23873001 0.91 KDM4E (0.70) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL13266595 0.91 KDM4E (0.65) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL12586782 0.91 KDM4E (0.65) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL1354918 0.89 HDAC6 (0.97) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL1354950 0.89 HDAC6 (0.91) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL13242583 0.88 KDM4E (0.62) KDM4EPOLBHDAC6HSD17B2KMT2A
SCHEMBL1829162 0.88 KDM4E (0.62) KDM4EPOLBHDAC6HSD17B2KMT2A

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-118234793-A Stabilizer based on syringic acid, vanillic acid, isovanillic acid or 5-hydroxyveratric acid, plastic composition, method for stabilizing a plastic composition and stabilizer composition 弗劳恩霍夫应用研究促进协会 2024-06-21 CN disclosed