SCHEMBL6204462

SCHEMBL6204462

Cn1c(Nc2cccc(C(F)(F)F)c2)nc2cc(Oc3ccncc3)ccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.72
RAF1 P04049 6/20 0.71
KDR P35968 7/20 0.62
LCK P06239 5/20 0.61
FYN P06241 5/20 0.61
PDGFRB P09619 5/20 0.61
KIT P10721 5/20 0.61
FLT1 P17948 5/20 0.61
FLT4 P35916 5/20 0.61
CYP3A4 P08684 3/20 0.61
SRC P12931 2/20 0.60
TNNI3K Q59H18 2/20 0.56
STK25 O00506 1/20 0.56
CIT O14578 1/20 0.56
EPHB6 O15197 1/20 0.56
MAP3K7 O43318 1/20 0.56
RIPK2 O43353 1/20 0.56
PAK3 O75914 1/20 0.56
STK10 O94804 1/20 0.56
MAP4K4 O95819 1/20 0.56

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
SCHEMBL13788619 0.88 BRAF (0.73) BRAFRAF1KDRLCKFYN
SCHEMBL4323637 0.84 BRAF (1.00) BRAFRAF1KDRLCKFYN
SCHEMBL13211389 0.83 BRAF (0.73) BRAFRAF1KDRLCKFYN
SCHEMBL6701429 0.83 BRAF (0.69) BRAFRAF1KDRLCKFYN
SCHEMBL2889336 0.83 BRAF (0.70) BRAFRAF1KDRLCKFYN
SCHEMBL6701432 0.83 BRAF (0.69) BRAFRAF1KDRLCKFYN
SCHEMBL13559539 0.83 BRAF (0.69) BRAFRAF1KDRLCKFYN
SCHEMBL2887083 0.83 BRAF (1.00) BRAFRAF1KDRLCKFYN
SCHEMBL2886149 0.82 BRAF (0.75) BRAFRAF1KDRLCKFYN
SCHEMBL13211229 0.82 BRAF (0.72) BRAFRAF1KDRLCKFYN

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
EP-1499311-A1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS Chiron Corporation (US) 2005-01-26 EP disclosed
WO-2003082272-A1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS CHIRON CORPORATION (US) 2003-10-09 WO disclosed