SCHEMBL28610679

SCHEMBL28610679

OCC(O)C(O)C(O)c1cnc2ccccc2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 2/20 0.41
GAA P10253 2/20 0.41
PDE10A Q9Y233 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 2/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C9 P11712 1/20 0.37
HIF1A Q16665 1/20 0.37
HTT P42858 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BCHE P06276 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL6389167 0.78 ALDH1A1 (0.41) L3MBTL1KDM4EALDH1A1HPGDALOX15
SCHEMBL7107145 0.78 RAB9A (0.43) L3MBTL1KDM4EALDH1A1GAAPOLB
SCHEMBL7099814 0.78 RAB9A (0.43) L3MBTL1KDM4EALDH1A1GAAPOLB
SCHEMBL7453224 0.78 ALDH1A1 (0.52) KDM4EALDH1A1GAAPDE10APOLB
SCHEMBL6744312 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2
SCHEMBL6743153 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2
SCHEMBL6743645 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2
SCHEMBL6740171 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2
SCHEMBL6741431 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2
SCHEMBL5596018 0.77 L3MBTL1 (0.43) L3MBTL1KDM4ECYP1A2

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-109738538-B Method for identifying natural sealed mature honey and hot processed concentrated honey 中国农业科学院蜜蜂研究所 2021-08-31 CN claimed