SCHEMBL8411908

SCHEMBL8411908

FC(Br)=CCOc1cc(Cl)c(OCCCCOc2ccc(Cl)cc2)c(Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.39
DRD2 P14416 3/20 0.39
DRD3 P35462 3/20 0.39
RHOC P08134 1/20 0.36
RHOA P61586 1/20 0.36
ALDH3A1 P30838 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.35
KCNA3 P22001 1/20 0.35
KCNA5 P22460 1/20 0.35
HRH3 Q9Y5N1 7/20 0.35
ALDH1A1 P00352 1/20 0.35
KCNH2 Q12809 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYSLTR2 Q9NS75 1/20 0.34

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
SCHEMBL8411906 1.00 DRD4 (0.39) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8345741 0.97 DRD4 (0.39) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8345739 0.97 DRD4 (0.39) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8339530 0.92 DRD4 (0.38) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8339525 0.92 DRD4 (0.38) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8345352 0.89 DRD4 (0.41) DRD4DRD2DRD3ALDH1A1
SCHEMBL8345354 0.89 DRD4 (0.41) DRD4DRD2DRD3ALDH1A1
SCHEMBL8413131 0.88 DRD4 (0.37) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8413129 0.88 DRD4 (0.37) DRD4DRD2DRD3RHOCRHOA
SCHEMBL8338875 0.88 FFAR4 (0.40) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787710-B1 Fluoropropene compound, an insecticide containing the same and an intermediate for production thereof SUMITOMO CHEMICAL CO (JP) 1999-07-28 EP claimed