SCHEMBL7056521

SCHEMBL7056521

CC[S+]([O-])Nc1cc(-n2nc(C(F)(F)F)n(C)c2=O)c(F)cc1C(N)=S

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 20/20 0.44

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
SCHEMBL39236 0.83 DHODH (0.43) DHODH
SCHEMBL6309814 0.81 DHODH (0.45) DHODH
SCHEMBL16208058 0.75 DHODH (0.40) DHODH
Chlorthiamid SCHEMBL5268335 0.75 DHODH (0.42) DHODH
SCHEMBL6310221 0.74 DHODH (0.38) DHODH
SCHEMBL6310984 0.74 DHODH (0.38) DHODH
SCHEMBL7628626 0.71 DHODH (0.40) DHODH
SCHEMBL6309209 0.69 DHODH (0.43) DHODH
SCHEMBL8517457 0.69 DHODH (0.47) DHODH
SCHEMBL16324720 0.66 DHODH (0.41) DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1453377-A1 HERBICIDES BASED ON SUBSTITUTED CARBOXYLIC ACID ANILIDES Bayer CropScience AG (DE) 2004-09-08 EP disclosed
EP-1423005-A1 HERBICIDAL MIXTURES BASED ON SUBSTITUTED ARYL KETONES Bayer CropScience AG (DE) 2004-06-02 EP disclosed
WO-2003047346-A1 HERBICIDES BASED ON SUBSTITUTED CARBOXYLIC ACID ANILIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-06-12 WO disclosed
WO-2003020033-A1 HERBICIDAL MIXTURES BASED ON SUBSTITUTED ARYL KETONES BAYER CROPSCIENCE AG (DE) 2003-03-13 WO disclosed