Benzoin

Benzoin

SCHEMBL28410834

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

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.66
▸ CES2 O00748 1/20 0.66
▸ CES1 P23141 1/20 0.66
▸ ALDH1A1 P00352 5/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.53
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.41
▸ HPGD P15428 1/20 0.40
▸ ADRB2 P07550 1/20 0.40

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 SCHEMBL1788856 0.98 LMNA (0.64) LMNACES2CES1ALDH1A1CYP3A4
SCHEMBL25827 0.92 ALDH1A1 (0.64) LMNACES2CES1ALDH1A1CYP3A4
Hydrogen Peroxide SCHEMBL28172808 0.92 ALDH1A1 (0.64) LMNACES2CES1ALDH1A1CYP3A4
Benzoin SCHEMBL25826 0.90 LMNA (0.75) LMNACES2CES1ALDH1A1CYP3A4
Hydrogen Sulfide SCHEMBL28273341 0.90 ALDH1A1 (0.62) LMNACES2CES1ALDH1A1CYP3A4
Water SCHEMBL27786448 0.90 ALDH1A1 (0.62) LMNACES2CES1ALDH1A1CYP3A4
Methyl Alcohol SCHEMBL27283147 0.90 ALDH1A1 (0.62) LMNACES2CES1ALDH1A1CYP3A4
Benzoin SCHEMBL27504403 0.90 LMNA (0.75) LMNACES2CES1ALDH1A1CYP3A4
Benzoin SCHEMBL27283150 0.89 LMNA (0.72) LMNACES2CES1ALDH1A1CYP3A4
Benzoin SCHEMBL22499691 0.87 LMNA (0.70) LMNACES2CES1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113261152-A Separator for lithium secondary battery and lithium secondary battery including the same 三星SDI株式会社 2021-08-13 — — CN disclosed
CN-111286297-A High-strength ultraviolet/moisture dual-curing adhesive and preparation method and use method thereof 天津斯多福新材料研发有限公司 2020-06-16 — — CN disclosed
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