SCHEMBL8669834

SCHEMBL8669834

CS(=O)(=O)c1c(Oc2ccncn2)cccc1C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.39
KDR P35968 1/20 0.39
MAPK14 Q16539 1/20 0.39
TNNI3K Q59H18 1/20 0.39
NR1H3 Q13133 5/20 0.36
NR1H2 P55055 4/20 0.36
RXRA P19793 1/20 0.36
SLC22A12 Q96S37 2/20 0.35
NFE2L2 Q16236 4/20 0.35
SCN9A Q15858 1/20 0.35
HTR2C P28335 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8665228 0.84 BRAF (0.34) BRAFKDRMAPK14TNNI3KSLC22A12
SCHEMBL8666414 0.79 BRAF (0.34) BRAFKDRMAPK14TNNI3K
SCHEMBL8665890 0.79 KDR (0.34) BRAFKDRMAPK14TNNI3KKDM4E
SCHEMBL8670005 0.79 SCN9A (0.35) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8669895 0.78 BRAF (0.33) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8666832 0.78 BRAF (0.33) BRAFKDRMAPK14TNNI3K
SCHEMBL8665290 0.77 HPGD (0.38) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8668430 0.77 BRAF (0.38) BRAFKDRMAPK14TNNI3KHTR2C
SCHEMBL8668648 0.74 KDR (0.34) BRAFKDRMAPK14TNNI3KHTR2C
SCHEMBL8740250 0.73 NFE2L2 (0.43) NR1H3NR1H2SLC22A12NFE2L2KDM4E

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
US-5723412-A HERBICIDES KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1998-03-03 US disclosed