SCHEMBL28410591

SCHEMBL28410591

CC(=O)ONC(=O)c1ncc(OS(=O)(=O)C(F)(F)F)cc1O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 15/20 0.39
TLR7 Q9NYK1 1/20 0.36
EGLN3 Q9H6Z9 2/20 0.34
CFTR P13569 2/20 0.33
CYP2C9 P11712 1/20 0.33
VEGFA P15692 1/20 0.33
FLT1 P17948 1/20 0.33
HSD11B1 P28845 1/20 0.33
CXCR2 P25025 1/20 0.33

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
Acetic Acid Methyl Ester SCHEMBL28417676 0.84 SMN1; SMN2 (0.37) EGLN1EGLN3VEGFAFLT1HSD11B1
SCHEMBL30957056 0.81 EGLN1 (0.37) EGLN1TLR7EGLN3CFTRCYP2C9
SCHEMBL1921245 0.80 EGLN1 (0.51) EGLN1EGLN3VEGFAFLT1
SCHEMBL13095592 0.79 EGLN1 (0.62) EGLN1EGLN3VEGFAFLT1
SCHEMBL1921259 0.79 EGLN1 (0.44) EGLN1TLR7EGLN3VEGFAFLT1
SCHEMBL27772388 0.79 EGLN1 (0.38) EGLN1EGLN3VEGFAFLT1
SCHEMBL16181326 0.77 EGLN1 (0.48) EGLN1EGLN3VEGFAFLT1
SCHEMBL14150782 0.76 EGLN1 (0.47) EGLN1EGLN3VEGFAFLT1
SCHEMBL14150780 0.76 EGLN1 (0.47) EGLN1EGLN3VEGFAFLT1
SCHEMBL1921247 0.76 CA1 (0.32) EGLN1HSD11B1CXCR2

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
CN-111320577-A Preparation method and application of picolinamide 广东东阳光药业有限公司 2020-06-23 CN disclosed