Benzoin

Benzoin

SCHEMBL28129668

NCCC(=O)Cc1ccc(N2CCOCC2)cc1.O=C(c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 3/20 0.45
CES2 O00748 1/20 0.45
CES1 P23141 1/20 0.45
MAPT P10636 5/20 0.42
ALDH1A1 P00352 5/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
RAB9A P51151 3/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
AOC3 Q16853 2/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
PRKDC P78527 1/20 0.41

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
SCHEMBL8411898 0.84 SMN1; SMN2 (0.53) SMN1; SMN2LMNAMAPTALDH1A1KMT2A
SCHEMBL25062239 0.83 LMNA (0.57) SMN1; SMN2LMNACES2CES1MAPT
SCHEMBL28061298 0.80 SMN1; SMN2 (0.50) SMN1; SMN2LMNAMAPTALDH1A1KMT2A
Benzoin SCHEMBL28129669 0.77 LMNA (0.45) SMN1; SMN2LMNACES2CES1MAPT
Benzoin SCHEMBL27873787 0.75 LMNA (0.40) SMN1; SMN2LMNACES2CES1MAPT
SCHEMBL2321900 0.74 SMN1; SMN2 (0.60) SMN1; SMN2LMNAMAPTALDH1A1KMT2A
SCHEMBL28156039 0.73 SMN1; SMN2 (0.45) SMN1; SMN2LMNAMAPTALDH1A1KMT2A
Benzoin SCHEMBL28473817 0.73 CES2 (0.72) LMNACES2CES1ALDH1A1KMT2A
Benzoin SCHEMBL6467530 0.72 LMNA (0.70) SMN1; SMN2LMNACES2CES1MAPT
Benzoin SCHEMBL6909430 0.71 LMNA (0.81) SMN1; SMN2LMNACES2CES1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110402258-A Actinic-radiation curable composition, solidfied material and film DAINIPPON INK & CHEMICALS 2019-11-01 CN disclosed
CN-109328198-A Actinic-radiation curable composition and the film for using it DIC株式会社 2019-02-12 CN disclosed
CN-109312012-A Actinic-radiation curable composition and the film for using it DIC株式会社 2019-02-05 CN disclosed
CN-106459240-A Active energy ray-curable composition and film using same DIC株式会社 2017-02-22 CN disclosed