SCHEMBL14628992

SCHEMBL14628992

NC(=O)[C@H](O[C@H]1OC(C(=O)Nc2ccc(Br)cc2)=C[C@H](O)[C@@H]1O)[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@@H]1CO

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPAGT1 Q9H3H5 5/20 0.54
SLC28A1 O00337 1/20 0.38
SLC28A2 O43868 1/20 0.38
SLC29A1 Q99808 1/20 0.38
SLC28A3 Q9HAS3 1/20 0.38

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
SCHEMBL14628952 0.93 DPAGT1 (0.54) DPAGT1SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL14629020 0.93 DPAGT1 (0.55) DPAGT1
SCHEMBL14628995 0.92 DPAGT1 (0.54) DPAGT1
SCHEMBL14628918 0.91 DPAGT1 (0.54) DPAGT1
SCHEMBL14628973 0.91 DPAGT1 (0.54) DPAGT1
SCHEMBL14628907 0.91 DPAGT1 (0.52) DPAGT1
SCHEMBL14628974 0.91 DPAGT1 (0.52) DPAGT1
SCHEMBL14628962 0.90 DPAGT1 (0.53) DPAGT1
SCHEMBL14628969 0.90 DPAGT1 (0.52) DPAGT1
SCHEMBL14628971 0.90 DPAGT1 (0.61) DPAGT1

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
US-7157442-B2 Antibacterial compound SANKYO COMPANY, LIMITED (JP) 2007-01-02 US disclosed