SCHEMBL5826396

SCHEMBL5826396

CC[C@H](C)[C@H](NC(=O)c1csc(N2CC(O)C2)n1)C(O[SiH](C)C)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OGA O60502 3/20 0.35
ABCB1 P08183 1/20 0.33
ACACB O00763 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL5724114 0.92 OGA (0.37) OGAABCB1ACACBHRH3CNR2
SCHEMBL5724101 0.92 OGA (0.37) OGAABCB1ACACBHRH3CNR2
SCHEMBL5724145 0.90 ACACB (0.33) OGAABCB1ACACBHRH3
SCHEMBL5826410 0.89 ABCB1 (0.33) OGAABCB1ACACB
SCHEMBL5723866 0.88 OGA (0.34) OGAABCB1ACACBHRH3CNR2
SCHEMBL5724427 0.85 CNR2 (0.36) OGAABCB1ACACBHRH3CNR2
SCHEMBL5724432 0.85 CNR2 (0.36) OGAABCB1ACACBHRH3CNR2
SCHEMBL5723896 0.81 OGA (0.34) OGAACACBHRH3
SCHEMBL5723881 0.81 OGA (0.34) OGAACACBHRH3
SCHEMBL5724277 0.80 OGA (0.35) OGAABCB1ACACBHRH3

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-7001897-B2 1-methylcarbapenem derivatives SANKYO COMPANY, LIMITED (JP) 2006-02-21 US disclosed