SCHEMBL9557828

SCHEMBL9557828

CCOC(=O)C(Cl)Cc1cc(-n2nc(C)n(C(F)F)c2=O)c(Cl)cc1Cl

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PPOX P50336 1/20 0.52

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
SCHEMBL8146388 0.93 PPOX (0.53) PPOX
Carfentrazone-Ethyl SCHEMBL38936 0.92 PPOX (0.43) PPOX
Carfentrazone-Ethyl SCHEMBL29436144 0.92 PPOX (0.43) PPOX
Carfentrazone-Ethyl SCHEMBL28318124 0.91 PPOX (0.42) PPOX
SCHEMBL8652375 0.89 PPOX (0.53) PPOX
Carfentrazone-Ethyl SCHEMBL18765264 0.89 PPOX (0.43) PPOX
Carfentrazone-Ethyl SCHEMBL457284 0.88 PPOX (0.41) PPOX
Carfentrazone-Ethyl SCHEMBL19642076 0.88 PPOX (0.41) PPOX
Carfentrazone-Ethyl SCHEMBL7587307 0.86 PPOX (0.66) PPOX
SCHEMBL7109551 0.86 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017041230-A1 HERBICIDAL CHLOROMETHYL TRIAZOLINONES ACENEOBIOCHEM, INC. (CN) 2017-03-16 WO disclosed
US-5217520-A Synergistic mixture of a phenylprionate and a monoammoium 2-amino-4-((hydroxy) methylphosphinyl) butanoate; pre and postemergence FMC CORPORATION (US) 1993-06-08 US disclosed
US-5125958-A Pre- and postemergence FMC CORPORATION (US) 1992-06-30 US disclosed