SCHEMBL2432193

SCHEMBL2432193

Nc1cc(Oc2ccc3c(c2)OCCN3C(=O)Nc2ccc(F)c(C(F)(F)F)c2)ncn1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.56
FLT1 P17948 1/20 0.56
FLT4 P35916 1/20 0.56
KCNH2 Q12809 1/20 0.48
LCK P06239 5/20 0.46
MET P08581 5/20 0.46
TEK Q02763 5/20 0.46
BRAF P15056 2/20 0.45
MAPK14 Q16539 1/20 0.45
TNNI3K Q59H18 1/20 0.45
CDK8 P49336 2/20 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
SCHEMBL2435966 0.92 KDR (0.57) KDRFLT1FLT4KCNH2MET
SCHEMBL2435819 0.91 KDR (0.53) KDRFLT1FLT4LCKMET
SCHEMBL2435957 0.86 KDR (0.62) KDRFLT1FLT4LCKMET
SCHEMBL2434309 0.83 KDR (0.50) KDRFLT1FLT4KCNH2BRAF
SCHEMBL2437252 0.81 RAF1 (0.53) KDRFLT1FLT4LCKMET
SCHEMBL18615565 0.80 KDR (0.47) KDRLCKMETTEKBRAF
SCHEMBL2706559 0.79 KDR (0.46) KDRLCKMETTEK
SCHEMBL2434370 0.78 KDR (0.59) KDRFLT1FLT4KCNH2LCK
SCHEMBL2435014 0.78 KDR (0.52) KDRFLT1FLT4LCKMET
SCHEMBL2437406 0.78 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