SCHEMBL20141658

SCHEMBL20141658

COS(=O)(=O)N[C@@H]1O[C@@H](n2nc(SC[C@H](C)O)c3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ATG7 O95352 20/20 0.68

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
SCHEMBL20142202 0.83 ATG7 (0.63) ATG7
SCHEMBL20142034 0.83 ATG7 (0.61) ATG7
SCHEMBL20142763 0.81 ATG7 (1.00) ATG7
SCHEMBL20142272 0.81 ATG7 (1.00) ATG7
SCHEMBL20142275 0.81 ATG7 (1.00) ATG7
SCHEMBL20141736 0.79 ATG7 (0.62) ATG7
SCHEMBL20142783 0.75 ATG7 (1.00) ATG7
SCHEMBL22758694 0.70 ATG7 (1.00) ATG7
SCHEMBL20141763 0.69 ATG7 (1.00) ATG7
SCHEMBL20141570 0.69 ATG7 (1.00) ATG7

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
WO-2018089786-A1 ATG7 INHIBITORS AND THE USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2018-05-17 — — WO disclosed
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