Benzoic Acid Vinyl Ester

Benzoic Acid Vinyl Ester

SCHEMBL8400814

C=COC(=O)Cc1ccccc1.C=COC(=O)c1ccccc1

nearest known ligand 0.49

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A3 Q01959 1/20 0.46
PAM P19021 1/20 0.45
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.41
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
AKR1B1 P15121 1/20 0.41
F2 P00734 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
AKT1 P31749 1/20 0.39

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
Benzoic Acid Vinyl Ester SCHEMBL4628868 0.93 TSHR (0.42) KMT2ATDP1L3MBTL1ALDH1A1MAPK1
SCHEMBL163579 0.90 ALDH1A1 (0.55) KMT2AL3MBTL1ALDH1A1MAPK1PAM
Methyl Alcohol SCHEMBL4364856 0.86 TSHR (0.53) KMT2AL3MBTL1ALDH1A1MAPK1PAM
Benzoic Acid Vinyl Ester SCHEMBL14903 0.84 LMNA (0.56) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL28106984 0.84 LMNA (0.56) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL5014943 0.82 LMNA (0.54) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL6551336 0.82 LMNA (0.54) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL6552669 0.82 LMNA (0.54) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL5014521 0.82 LMNA (0.54) KMT2ATDP1ALDH1A1MAPK1SLC6A2
Benzoic Acid Vinyl Ester SCHEMBL6551316 0.82 LMNA (0.54) KMT2ATDP1ALDH1A1MAPK1SLC6A2

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
US-5985530-A MULTILAYER PHOTOGRAPHIC FILM WITH COLLOID LAYER KONICA CORPORATION (JP) 1999-11-16 US disclosed
EP-0823656-A2 Silver halide photographic light sensitive material KONICA CORPORATION (JP) 1998-02-11 EP disclosed