SCHEMBL9770849

SCHEMBL9770849

CC(C)Oc1cc(N=c2sc(=S)n3n2CCC=C3)c(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPOX P50336 2/20 0.33
GAA P10253 1/20 0.31

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
SCHEMBL9770990 0.89 PPOX (0.36) PPOX
SCHEMBL9770916 0.88 PPOX (0.34) PPOX
SCHEMBL9770876 0.78 BAZ2B (0.34) GAA
SCHEMBL9770861 0.78 PPOX (0.36) PPOX
SCHEMBL10339198 0.77 PPOX (0.36) PPOX
SCHEMBL8567526 0.76 PPOX (0.41) PPOX
SCHEMBL8567529 0.76 PPOX (0.41) PPOX
SCHEMBL9771013 0.75 POLB (0.33) GAA
SCHEMBL9770889 0.74 ALDH1A1 (0.34) GAA
SCHEMBL8615390 0.73

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
US-5039331-A Condensed heterocyclic derivatives and herbicides NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1991-08-13 US disclosed
EP-0304920-A2 Condensed heterocyclic derivatives, process for their production and herbicides NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1989-03-01 EP disclosed