SCHEMBL30967679

SCHEMBL30967679

CCC(=O)Oc1ccc(O)c(O)c1.COc1ccc(C(O)C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TSHR P16473 1/20 0.50
ESR1 P03372 2/20 0.46
HIF1A Q16665 2/20 0.46
POLB P06746 1/20 0.43
ACHE P22303 2/20 0.42
BCHE P06276 1/20 0.42
TYR P14679 1/20 0.42
AKR1C3 P42330 3/20 0.41
AKR1C2 P52895 3/20 0.41
AKR1C1 Q04828 1/20 0.41
PTGS1 P23219 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
PPARG P37231 1/20 0.40
ERCC1 P07992 1/20 0.39
ERCC4 Q92889 1/20 0.39

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
Mandelic Acid SCHEMBL30967654 0.90 LMNA (0.47) BLMNPSR1TSHRESR1HIF1A
Mandelic Acid SCHEMBL30967572 0.90 LMNA (0.47) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967623 0.89 TSHR (0.67) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967695 0.88 ESR1 (0.52) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967640 0.88 ESR1 (0.52) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967609 0.88 ESR1 (0.58) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967630 0.87 ESR1 (0.50) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967621 0.87 ESR1 (0.43) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967642 0.86 ACHE (0.47) BLMNPSR1TSHRESR1HIF1A
SCHEMBL30967683 0.85 BLM (0.46) BLMNPSR1TSHRESR1HIF1A

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-2024105203-A1 NOVEL ANTI-SENESCENCE COMPOUNDS VITEXIA APS (DK) 2024-05-23 WO disclosed