SCHEMBL9620002

SCHEMBL9620002

CCCCC1OC(=O)N(c2cc(OC(C)C)c(Cl)cc2F)C1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPOX P50336 13/20 0.45
MEN1 O00255 1/20 0.35
NR1I2 O75469 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
GAA P10253 1/20 0.33
KMO O15229 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
SCHEMBL9620064 0.82 PPOX (0.48) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL9619999 0.82 PPOX (0.47) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL9619976 0.78 PPOX (0.43) PPOXMEN1KMT2A
SCHEMBL9619884 0.76 PPOX (0.47) PPOXCYP1A2CYP2C19
SCHEMBL9619940 0.76 PPOX (0.54) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL9620198 0.75 PPOX (0.49) PPOX
SCHEMBL10419793 0.75 PPOX (0.54) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL10419792 0.75 PPOX (0.54) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL10420665 0.73 PPOX (0.46) PPOXMEN1NR1I2KMT2ATDP1
SCHEMBL9620031 0.71 PPOX (0.39) PPOX

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-5100457-A OXAZOLIDINEDIONE COMPOUNDS, THE PROCESS FOR PREPARING THE SAME AND HERBICIDAL COMPOSITION CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-03-31 US disclosed