Benzoin

Benzoin

SCHEMBL28200317

Cc1ccc(S(=O)(=O)O)c(S(=O)(=O)O)c1.O=C(c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.57
CES2 O00748 2/20 0.57
CES1 P23141 2/20 0.57
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.41
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
CYP2D6 P10635 1/20 0.39
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
SRC P12931 1/20 0.37
CYP3A4 P08684 1/20 0.36
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
PMP22 Q01453 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
Benzoin SCHEMBL60546 0.83 LMNA (0.64) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL708292 0.82 LMNA (0.62) LMNACES2CES1ALDH1A1KDM4E
SCHEMBL1607663 0.81 L3MBTL1 (0.50) LMNACES2CES1ALDH1A1L3MBTL1
Benzoin SCHEMBL384248 0.79 LMNA (0.78) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL8764252 0.79 LMNA (0.54) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL28391545 0.79 LMNA (0.84) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL710405 0.78 LMNA (0.75) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL28292944 0.77 CES2 (0.81) LMNACES2CES1ALDH1A1KDM4E
SCHEMBL66647 0.77 LMNA (0.74) LMNACES2CES1ALDH1A1KDM4E
SCHEMBL66803 0.77 LMNA (0.74) LMNACES2CES1ALDH1A1KDM4E

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-107703658-A The manufacture method of substrate 东京应化工业株式会社 2018-02-16 CN disclosed