SCHEMBL20141960

SCHEMBL20141960

NC(=S)c1nn([C@@H]2OC(COS(N)(=O)=O)C(O)[C@H]2O)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
SCHEMBL22758705 1.00 ATG7 (1.00) ATG7
SCHEMBL20142032 0.92 ATG7 (1.00) ATG7
SCHEMBL20142248 0.92 ATG7 (1.00) ATG7
SCHEMBL22758722 0.90 ATG7 (1.00) ATG7
SCHEMBL20142862 0.88 ATG7 (1.00) ATG7
SCHEMBL20141766 0.88 ATG7 (1.00) ATG7
SCHEMBL20141901 0.87 ATG7 (1.00) ATG7
SCHEMBL20142035 0.86 ATG7 (0.80) ATG7
SCHEMBL20141626 0.85 ATG7 (0.85) ATG7
SCHEMBL20142425 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