SCHEMBL29645196

SCHEMBL29645196

CC(=O)OC[C@@H](O)[C@](O)(C(C)=O)[C@@](O)(C(C)=O)[C@@](O)(C=O)C(C)=O

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.33
CYP3A4 P08684 3/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.31
RECQL P46063 1/20 0.31
MEN1 O00255 1/20 0.30
TP53 P04637 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 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
SCHEMBL28557963 1.00 USP2 (0.33) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL22129288 0.76 TDP1 (0.33) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30151172 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL21753645 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL8829437 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30346501 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30346659 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL30346502 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL28914556 0.75 TDP1 (0.31) USP2CYP3A4MAPTSMN1; SMN2ALDH1A1
SCHEMBL7570048 0.73

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-112608355-B Preparation method of tetraacetylglucose 北京悦康科创医药科技股份有限公司 2022-06-21 CN disclosed