SCHEMBL2435019

SCHEMBL2435019

CNc1cc(Oc2ccc3c(C(=O)Nc4ccc(N5CCOCC5)c(C(F)(F)F)c4)cccc3c2)ncn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.62
FLT1 P17948 5/20 0.58
FLT4 P35916 5/20 0.58
RET P07949 2/20 0.51
PDGFRB P09619 2/20 0.51
KIT P10721 2/20 0.51
BRAF P15056 4/20 0.51
RAF1 P04049 3/20 0.48
FGFR1 P11362 3/20 0.48
MAPK14 Q16539 2/20 0.47
TNNI3K Q59H18 2/20 0.47
STK25 O00506 1/20 0.47
CIT O14578 1/20 0.47
MAP2K7 O14733 1/20 0.47
IKBKB O14920 1/20 0.47
AURKA O14965 1/20 0.47
GAK O14976 1/20 0.47
CHUK O15111 1/20 0.47
MUSK O15146 1/20 0.47
MAPK13 O15264 1/20 0.47

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
SCHEMBL274622 0.84 KDR (0.63) KDRFLT1FLT4RETPDGFRB
SCHEMBL2437330 0.84 KDR (0.84) KDRFLT1FLT4RETPDGFRB
SCHEMBL274614 0.82 KDR (0.60) KDRFLT1FLT4RETPDGFRB
SCHEMBL274497 0.81 KDR (0.57) KDRFLT1FLT4RETPDGFRB
SCHEMBL273545 0.80 KDR (0.58) KDRFLT1FLT4RETPDGFRB
SCHEMBL278849 0.80 KDR (0.58) KDRFLT1FLT4RETPDGFRB
SCHEMBL273272 0.80 KDR (0.58) KDRFLT1FLT4RETPDGFRB
SCHEMBL274221 0.79 KDR (0.56) KDRFLT1FLT4RETPDGFRB
SCHEMBL279328 0.79 KDR (0.56) KDRFLT1FLT4RETPDGFRB
SCHEMBL273571 0.79 KDR (0.54) KDRFLT1FLT4RETPDGFRB

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