SCHEMBL8669895

SCHEMBL8669895

CS(=O)(=O)c1c(Oc2ccncn2)ccc(Cl)c1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.33
KDR P35968 2/20 0.33
MAPK14 Q16539 2/20 0.33
TNNI3K Q59H18 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
SCN9A Q15858 7/20 0.33
KMT2A Q03164 1/20 0.32
RAF1 P04049 2/20 0.32
MAPK3 P27361 2/20 0.32
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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 0.87 BRAF (0.34) BRAFKDRMAPK14TNNI3K
SCHEMBL8666414 0.87 BRAF (0.34) BRAFKDRMAPK14TNNI3K
SCHEMBL8665890 0.87 KDR (0.34) BRAFKDRMAPK14TNNI3K
SCHEMBL8670005 0.87 SCN9A (0.35) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8666832 0.86 BRAF (0.33) BRAFKDRMAPK14TNNI3KL3MBTL1
SCHEMBL8665290 0.85 HPGD (0.38) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8668648 0.81 KDR (0.34) BRAFKDRMAPK14TNNI3K
SCHEMBL8672951 0.79 KMT2A (0.34) BRAFKDRMAPK14TNNI3KKMT2A
SCHEMBL8669834 0.78 BRAF (0.39) BRAFKDRMAPK14TNNI3KSCN9A
SCHEMBL8667523 0.71 EGFR (0.36) BRAFKDRMAPK14TNNI3KKMT2A

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