Mandelic Acid

Mandelic Acid

SCHEMBL30967633

CCCOc1ccc(OC(=O)CC)cc1.O=C(O)C(O)c1ccccc1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.50
ESR1 P03372 3/20 0.48
HIF1A Q16665 2/20 0.48
LMNA P02545 4/20 0.47
MAPK1 P28482 2/20 0.47
SMN1; SMN2 Q16637 5/20 0.46
ALDH1A1 P00352 3/20 0.46
GPR88 Q9GZN0 1/20 0.46
KMT2A Q03164 3/20 0.46
FAAH O00519 1/20 0.45
MITF O75030 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
NLRP1 Q9C000 1/20 0.44
RECQL P46063 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL30967691 0.91 ESR1 (0.50) ELANEESR1HIF1ALMNAMAPK1
SCHEMBL30967678 0.90 FAAH (0.49) ELANEESR1HIF1ALMNASMN1; SMN2
SCHEMBL30967672 0.90 ESR1 (0.49) ELANEESR1HIF1ALMNASMN1; SMN2
Mandelic Acid SCHEMBL30967659 0.89 ELANE (0.52) ELANEESR1HIF1ALMNAMAPK1
SCHEMBL30967658 0.85 ESR1 (0.44) ESR1HIF1ALMNASMN1; SMN2ALDH1A1
SCHEMBL30967656 0.85 ESR1 (0.44) ESR1HIF1ALMNASMN1; SMN2ALDH1A1
SCHEMBL30967615 0.85 ALOX5 (0.47) ESR1HIF1ALMNAMAPK1ALDH1A1
SCHEMBL8323514 0.84 L3MBTL1 (0.53) LMNASMN1; SMN2ALDH1A1GPR88KMT2A
SCHEMBL3685459 0.84 L3MBTL1 (0.53) LMNASMN1; SMN2ALDH1A1GPR88KMT2A
SCHEMBL30967621 0.84 ESR1 (0.43) ESR1HIF1ALMNASMN1; SMN2ALDH1A1

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