SCHEMBL27325645

SCHEMBL27325645

CCOC(CC=O)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
PPARA Q07869 1/20 0.33
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
PTGS2 P35354 1/20 0.32

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
SCHEMBL27511801 0.82 ALOX15 (0.33) ALOX15PPARABCHEACHEPTGS2
SCHEMBL3339643 0.81 PPARA (0.44) PPARA
SCHEMBL6395180 0.78
SCHEMBL28036244 0.76
SCHEMBL6791844 0.74
SCHEMBL4692524 0.74 CA1 (0.39) ALOX15PPARA
SCHEMBL29896368 0.73 CA1 (0.31)
Acrylic Acid SCHEMBL27777949 0.73 PPARA (0.39) PPARA
SCHEMBL10781106 0.72 ALOX15 (0.36) ALOX15PPARA
Methacrylic Acid SCHEMBL28783237 0.72 PPARA (0.38) PPARA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1030657-C Process for the production of antibacterial compounds TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1996-01-10 CN disclosed
CN-86102034-A Process for the production of antibacterial compounds 1987-01-07 CN disclosed
CN-85105797-A The preparation of antimicrobial compounds 1986-08-27 CN disclosed