Benzylic Acid

Benzylic Acid

SCHEMBL7559896

O=C(O)C(O)(c1ccccc1)c1ccccc1.O=C(O)C(O)c1ccccc1

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.67
MAPK1 P28482 1/20 0.67
CYP2C9 P11712 2/20 0.53
CYP2D6 P10635 3/20 0.50
HIF1A Q16665 1/20 0.50
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
SRC P12931 2/20 0.42
HPGD P15428 1/20 0.42
CYP1A2 P05177 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.37

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 SCHEMBL8757198 0.82 LMNA (0.62) LMNAMAPK1CYP2D6HIF1ACES2
Mandelic Acid SCHEMBL1050 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Mandelic Acid SCHEMBL165161 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Mandelic Acid SCHEMBL21647917 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Mandelic Acid SCHEMBL255601 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Benzylic Acid SCHEMBL7066 0.82 CYP2C9 (0.74) LMNACYP2C9CYP2D6HIF1ACNR1
Mandelic Acid SCHEMBL5313046 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Mandelic Acid SCHEMBL29777368 0.82 LMNA (1.00) LMNAMAPK1CYP2D6CES2CES1
Benzylic Acid SCHEMBL28230036 0.81 CYP2C9 (0.58) LMNAMAPK1CYP2C9CYP2D6HIF1A
Mandelic Acid SCHEMBL1374278 0.80 LMNA (0.95) LMNAMAPK1CYP2D6CES2CES1

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-2002067890-A2 METHOD AND PRODUCT FOR SKIN LIGHTENING UNILEVER PLC (GB) 2002-09-06 WO disclosed