SCHEMBL2434370

SCHEMBL2434370

Nc1nccc(Oc2ccc3c(c2)OCN3C(=O)Nc2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.59
FLT1 P17948 3/20 0.59
FLT4 P35916 3/20 0.59
CDK8 P49336 3/20 0.49
CDK1 P06493 1/20 0.49
CDK2 P24941 1/20 0.49
RET P07949 1/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
BRAF P15056 3/20 0.43
KCNH2 Q12809 1/20 0.43
MET P08581 3/20 0.41
LCK P06239 1/20 0.40
TEK Q02763 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
SCHEMBL2434130 0.89 KDR (0.45) KDRFLT1FLT4CDK8BRAF
SCHEMBL2435966 0.86 KDR (0.57) KDRFLT1FLT4CDK8BRAF
SCHEMBL2433250 0.86 KDR (0.60) KDRFLT1FLT4CDK8CDK1
SCHEMBL273466 0.83 KDR (0.54) KDRFLT1FLT4CDK8CDK2
SCHEMBL2434309 0.83 KDR (0.50) KDRFLT1FLT4BRAFKCNH2
SCHEMBL2435014 0.83 KDR (0.52) KDRFLT1FLT4CDK8CDK1
SCHEMBL12972322 0.83 KDR (0.58) KDRFLT1FLT4CDK8CDK1
SCHEMBL274235 0.80 KDR (0.51) KDRFLT1FLT4CDK8CDK2
SCHEMBL2436643 0.79 CDK8 (0.61) KDRFLT1FLT4CDK8CDK1
SCHEMBL2707860 0.78 KDR (0.43) KDRFLT1FLT4CDK8CDK1

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