SCHEMBL20142096

SCHEMBL20142096

COc1nn([C@H]2C[C@@H](O)[C@@H](COS(N)(=O)=O)O2)c2ncnc(N)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ATG7 O95352 20/20 1.00

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
SCHEMBL20141991 1.00 ATG7 (1.00) ATG7
SCHEMBL20141655 1.00 ATG7 (1.00) ATG7
SCHEMBL20142636 0.90 ATG7 (0.82) ATG7
SCHEMBL20142444 0.89 ATG7 (1.00) ATG7
SCHEMBL20142204 0.88 ATG7 (1.00) ATG7
SCHEMBL20141756 0.88 ATG7 (0.80) ATG7
SCHEMBL20141594 0.88 ATG7 (1.00) ATG7
SCHEMBL20141771 0.88 ATG7 (1.00) ATG7
SCHEMBL22758711 0.88 ATG7 (1.00) ATG7
SCHEMBL20142477 0.85 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