SCHEMBL8773801

SCHEMBL8773801

Fc1ccc(Oc2cc(Oc3ccc(Cl)c(C(F)(F)F)c3)ncn2)cc1C(F)(F)F.Oc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.47
BRAF P15056 3/20 0.45
RAF1 P04049 4/20 0.43
MAPK3 P27361 4/20 0.43
PLA2G7 Q13093 2/20 0.41
FLT1 P17948 1/20 0.41
FLT4 P35916 1/20 0.41
KMO O15229 1/20 0.41
MAP2K7 O14733 1/20 0.40

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
SCHEMBL679527 0.93 KDR (0.49) KDRBRAFRAF1MAPK3PLA2G7
SCHEMBL8773810 0.89 KDR (0.46) KDRBRAFRAF1MAPK3FLT1
SCHEMBL7885604 0.86 RAF1 (0.49) KDRBRAFRAF1MAPK3PLA2G7
SCHEMBL6938479 0.84 KDR (0.48) KDRBRAFPLA2G7FLT1FLT4
SCHEMBL7781852 0.81 KDR (0.48) KDRBRAFRAF1MAPK3FLT1
SCHEMBL7776445 0.81 RAF1 (0.46) KDRBRAFRAF1MAPK3PLA2G7
SCHEMBL8773800 0.81 KDR (0.48) KDRBRAFRAF1MAPK3FLT1
SCHEMBL8199428 0.80 KDR (0.44) KDRBRAFRAF1MAPK3PLA2G7
SCHEMBL7791086 0.79 KDR (0.49) KDRBRAFRAF1MAPK3PLA2G7
SCHEMBL3366738 0.79 EGFR (0.46) KDRBRAFRAF1PLA2G7

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-0794177-A1 Process for the preparation of unsymmertical 4,6-Bis (aryloxy pyrimidine compounds American Cyanamid Company (US) 1997-09-10 EP disclosed