Benzoin

Benzoin

SCHEMBL28085629

CC(=O)c1ccccc1.CC(C)OC(C)C.CCOCC.COC.O=C(c1ccccc1)C(O)c1ccccc1.O=C(c1ccccc1)C(O)c1ccccc1.O=C(c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
CES2 O00748 1/20 0.53
CES1 P23141 1/20 0.53
ALDH1A1 P00352 7/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP3A4 P08684 1/20 0.40
PGR P06401 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
KCNH2 Q12809 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 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 SCHEMBL6261151 0.95 LMNA (0.58) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL11570177 0.92 LMNA (0.62) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL923010 0.92 LMNA (0.62) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL28109422 0.89 LMNA (0.66) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL3813338 0.88 LMNA (0.68) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL28098095 0.88 LMNA (0.40) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL22499691 0.87 LMNA (0.70) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL11699337 0.85 LMNA (0.68) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL30282 0.85 LMNA (0.72) LMNACES2CES1ALDH1A1KDM4E
Benzoin SCHEMBL16649153 0.85 LMNA (0.72) 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-103116246-B A kind of photosensitive polymer combination and application thereof 村上精密制版(昆山)有限公司 2016-07-06 CN claimed