SCHEMBL6533119

SCHEMBL6533119

C1CCOCC1.O=C1NCCO1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
LMNA P02545 1/20 0.33
CA1 P00915 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP2C9 P11712 1/20 0.31
FABP6 P51161 1/20 0.30

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
Dioxane SCHEMBL993246 0.88 GAA (0.46) GAAALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL4621927 0.85 FABP6 (0.35) GAAALDH1A1SMN1; SMN2HTTLMNA
SCHEMBL4198 0.85
SCHEMBL969300 0.85
SCHEMBL29186798 0.85 GAA (0.38) GAAALDH1A1SMN1; SMN2HTTLMNA
Fluoride SCHEMBL27461973 0.85
SCHEMBL80643 0.85
Morpholine SCHEMBL28460086 0.84 GAA (0.50) GAASMN1; SMN2HTTLMNAMEN1
SCHEMBL6678827 0.83
SCHEMBL1969512 0.83

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-2005113520-A1 SUBSTITUTED 2,3,5-TRIFLUORPHENYL OXAZOLIDINONES FOR USE AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2005-12-01 WO disclosed