SCHEMBL9835969

SCHEMBL9835969

CC(C)=C1OC(=O)N(c2cc(OC(C)C)c(Cl)cc2Cl)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPOX P50336 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NR1I2 O75469 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
GAA P10253 3/20 0.41
CYP2C9 P11712 3/20 0.40
CYP2C19 P33261 3/20 0.40
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
ALOX12 P18054 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KMO O15229 2/20 0.36
HPGD P15428 3/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RORC P51449 1/20 0.36
LMNA P02545 2/20 0.35

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
SCHEMBL9577463 0.89 PPOX (0.47) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL9834577 0.84 CUL4A (0.45) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL9834281 0.79 HPGD (0.33) HPGDTSHRHSD17B10
SCHEMBL9619952 0.78 PPOX (0.44) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL8886715 0.78 PPOX (0.44) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL7592035 0.78 PPOX (0.39) PPOX
SCHEMBL9814284 0.77 GAA (0.45) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL9577667 0.76 PPOX (0.48) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL9655304 0.76 CYP2C9 (0.43) PPOXMEN1KMT2ANR1I2TDP1
SCHEMBL11218076 0.76 PPOX (0.49) PPOXMEN1KMT2ANR1I2TDP1

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
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed