SCHEMBL2435819

SCHEMBL2435819

Cc1ccc(NC(=O)N2CCOc3cc(Oc4cc(N)ncn4)ccc32)cc1C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.53
HCK P08631 1/20 0.47
NR2C2 P49116 1/20 0.47
LCK P06239 8/20 0.46
MET P08581 8/20 0.46
TEK Q02763 8/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
BRAF P15056 1/20 0.45
MAPK14 Q16539 1/20 0.45
TNNI3K Q59H18 1/20 0.45

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
SCHEMBL2432193 0.91 KDR (0.56) KDRLCKMETTEKFLT1
SCHEMBL2437252 0.90 RAF1 (0.53) KDRHCKNR2C2LCKMET
SCHEMBL2435014 0.87 KDR (0.52) KDRLCKMETTEKFLT1
SCHEMBL2435957 0.85 KDR (0.62) KDRLCKMETTEKFLT1
SCHEMBL2435232 0.84 KDR (0.54) KDRLCKMETTEK
SCHEMBL2434058 0.83 KDR (0.53) KDRLCKMETTEK
SCHEMBL2435966 0.83 KDR (0.57) KDRMETFLT1FLT4BRAF
SCHEMBL22528714 0.78 KDR (0.70) KDRFLT1FLT4BRAFMAPK14
SCHEMBL2706559 0.78 KDR (0.46) KDRLCKMETTEK
SCHEMBL2437406 0.77 KDR (0.63) KDRFLT1FLT4BRAFMAPK14

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-8026247-B2 Bicyclic amides as kinase inhibitors NOVARTIS AG (CH) 2011-09-27 US disclosed