SCHEMBL2433982

SCHEMBL2433982

Nc1nccc(Oc2ccc3c(c2)OCCN3C(=O)Nc2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.58
FLT1 P17948 2/20 0.58
FLT4 P35916 2/20 0.58
RET P07949 1/20 0.58
PDGFRB P09619 1/20 0.58
KIT P10721 1/20 0.58
LCK P06239 6/20 0.51
MET P08581 6/20 0.51
TEK Q02763 6/20 0.51
BRAF P15056 2/20 0.47
MAPK14 Q16539 2/20 0.47
TNNI3K Q59H18 2/20 0.47
GPR142 Q7Z601 1/20 0.44

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
SCHEMBL2433250 0.92 KDR (0.60) KDRFLT1FLT4RETPDGFRB
SCHEMBL10261435 0.88 KDR (0.67) KDRLCKMETTEK
SCHEMBL2435957 0.86 KDR (0.62) KDRFLT1FLT4LCKMET
SCHEMBL12972303 0.86 KDR (0.61) KDRFLT1FLT4RETPDGFRB
SCHEMBL2435014 0.86 KDR (0.52) KDRFLT1FLT4LCKMET
SCHEMBL12972314 0.85 KDR (0.59) KDRFLT1FLT4RETPDGFRB
SCHEMBL12972255 0.84 KDR (0.58) KDRFLT1FLT4RETPDGFRB
SCHEMBL10261459 0.82 KDR (0.52) KDRLCKMETTEKBRAF
SCHEMBL12024426 0.82 KDR (0.72) KDRFLT1FLT4RETPDGFRB
SCHEMBL2437401 0.82 KDR (0.62) KDRBRAFMAPK14TNNI3K

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