SCHEMBL9710836

SCHEMBL9710836

C#CC(C)Oc1cc(-n2c(Cl)c(C#N)n(CC)c2=O)c(F)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPOX P50336 6/20 0.35
DHODH Q02127 9/20 0.33
BCAT2 O15382 2/20 0.30
BCAT1 P54687 2/20 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
SCHEMBL9711090 0.84 PGK1 (0.37) PPOXBCAT2BCAT1
SCHEMBL9710764 0.82 PPOX (0.36) PPOXDHODHBCAT2BCAT1
SCHEMBL9710838 0.80 PPOX (0.35) PPOX
SCHEMBL9710767 0.77 PGK1 (0.36) PPOXBCAT2BCAT1
SCHEMBL9710626 0.76 PPOX (0.38) PPOXDHODH
SCHEMBL9710681 0.76 PPOX (0.39) PPOXDHODH
SCHEMBL9710662 0.73 PPOX (0.36) PPOXDHODH
SCHEMBL9710891 0.71 PGK1 (0.36) PPOXBCAT2BCAT1
SCHEMBL9710695 0.70 PPOX (0.45) PPOXBCAT2BCAT1
SCHEMBL9189746 0.70 BCAT1 (0.42) PPOXBCAT2BCAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992021662-A1 POSSIBLY CONDENSED PHENYLIMIDAZOLONES AND PYRIMIDINONES AS HERBICIDES; INTERMEDIATES DOWELANCO (US) 1992-12-10 WO disclosed
US-5153316-A Post and preemergence herbicides DOWELANCO 1992-10-06 US disclosed