SCHEMBL14628958

SCHEMBL14628958

NC(=O)[C@H](O[C@H]1OC(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)=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 0.56

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DPAGT1 Q9H3H5 5/20 0.49

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
SCHEMBL14628910 0.93 DPAGT1 (0.52) DPAGT1
SCHEMBL14628956 0.91 DPAGT1 (0.51) DPAGT1
SCHEMBL13618332 0.90 DPAGT1 (0.58) DPAGT1
SCHEMBL14628907 0.90 DPAGT1 (0.52) DPAGT1
SCHEMBL14629100 0.90 DPAGT1 (0.54) DPAGT1
SCHEMBL14628952 0.89 DPAGT1 (0.54) DPAGT1
SCHEMBL14629025 0.89 DPAGT1 (0.52) DPAGT1
SCHEMBL14629004 0.89 DPAGT1 (0.49) DPAGT1
SCHEMBL14628971 0.88 DPAGT1 (0.61) DPAGT1
SCHEMBL14628992 0.87 DPAGT1 (0.54) 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