SCHEMBL28404274

SCHEMBL28404274

O=C(O)CC(NS(=O)(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.76
L3MBTL1 Q9Y468 2/20 0.76
ALDH1A1 P00352 1/20 0.76
EEF2K O00418 7/20 0.74
ITGB3 P05106 6/20 0.59
ITGAV P06756 6/20 0.59
KMT2A Q03164 1/20 0.52
ADAMTS4 O75173 1/20 0.51

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
SCHEMBL7572130 0.90 ATM (0.76) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL6772863 0.87 EEF2K (0.66) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL7360031 0.86 EEF2K (1.00) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL28408144 0.86 EEF2K (1.00) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL28398275 0.86 EEF2K (0.80) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL7144205 0.86 EEF2K (0.64) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL644240 0.84 EEF2K (0.66) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL3310158 0.84 EEF2K (0.66) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL5651951 0.84 EEF2K (0.59) ATML3MBTL1ALDH1A1EEF2KITGB3
SCHEMBL4141080 0.83 EEF2K (0.64) ATML3MBTL1ALDH1A1EEF2KITGB3

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-107903185-B Preparation and application of novel eEF2K inhibitor 四川大学 2020-05-26 CN disclosed