SCHEMBL30151172

SCHEMBL30151172

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

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
USP2 O75604 2/20 0.30
ALDH1A1 P00352 2/20 0.30
CYP3A4 P08684 2/20 0.30
MAPT P10636 2/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
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
SCHEMBL28914556 1.00 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL21753645 0.84 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL8829437 0.84 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL30346501 0.84 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL30346659 0.84 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL30346502 0.84 TDP1 (0.31) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL30763279 0.76 TDP1 (0.33) TDP1ALDH1A1
SCHEMBL28403501 0.76 TDP1 (0.33) TDP1ALDH1A1
SCHEMBL29645196 0.75 USP2 (0.33) TDP1USP2ALDH1A1CYP3A4MAPT
SCHEMBL28557963 0.75 USP2 (0.33) TDP1USP2ALDH1A1CYP3A4MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115463152-B Multifunctional p53 reviving medicine and application thereof 上海交通大学医学院附属瑞金医院 2024-08-13 CN disclosed
CN-115463152-A Multifunctional p53 revival medicine and application thereof 上海交通大学医学院附属瑞金医院 2022-12-13 CN disclosed