SCHEMBL7056629

SCHEMBL7056629

CC(=O)C(O)[C@H]1O[C@@H](NC(=O)c2ccccc2)[C@](O)(C(C)=O)[C@](O)(C(C)=O)[C@@]1(O)C(C)=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LGALS9 O00182 1/20 0.33
LGALS1 P09382 1/20 0.33
LGALS3 P17931 1/20 0.33
LGALS7; LGALS7B P47929 1/20 0.33
EZH2 Q15910 1/20 0.32
KDM4E B2RXH2 3/20 0.32
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 4/20 0.32
GAA P10253 1/20 0.32
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 3/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 2/20 0.30

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
SCHEMBL3264160 0.81
SCHEMBL14895407 0.76
SCHEMBL9049283 0.75
SCHEMBL9049291 0.75
SCHEMBL9789419 0.75
SCHEMBL7999401 0.74 MEN1 (0.30) MEN1KMT2A
SCHEMBL8416405 0.74 MEN1 (0.30) MEN1KMT2A
SCHEMBL16897745 0.74 MEN1 (0.30) MEN1KMT2A
SCHEMBL3179340 0.72 TRPV1 (0.37) MEN1KMT2A
SCHEMBL16098780 0.71 ALDH1A1 (0.31) ALDH1A1

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
WO-2003018598-A2 MONOSACCHARIDE DERIVATIVES UNIVERSITY COLLEGE DUBLIN (IE) 2003-03-06 WO disclosed