SCHEMBL2433252

SCHEMBL2433252

Nc1cc(S(=O)(=O)c2ccc3c(C(=O)Nc4cccc(C(F)(F)F)c4)cccc3c2)ncn1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.68
FLT1 P17948 4/20 0.68
FLT4 P35916 4/20 0.68
RET P07949 2/20 0.56
PDGFRB P09619 2/20 0.56
KIT P10721 2/20 0.56
RXFP1 Q9HBX9 3/20 0.52
PTGS1 P23219 1/20 0.49
GAA P10253 1/20 0.46
AHR P35869 1/20 0.46
HSD17B10 Q99714 1/20 0.46
P2RX1 P51575 1/20 0.45
BRAF P15056 1/20 0.45
MAPK14 Q16539 1/20 0.45
TNNI3K Q59H18 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LCK P06239 1/20 0.44
TEK Q02763 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
SCHEMBL2432219 0.81 KDR (0.70) KDRFLT1FLT4RETPDGFRB
SCHEMBL2434062 0.81 KDR (1.00) KDRFLT1FLT4RETPDGFRB
SCHEMBL2436197 0.81 KDR (0.67) KDRFLT1FLT4RETPDGFRB
SCHEMBL2435774 0.80 KDR (0.68) KDRFLT1FLT4RETPDGFRB
SCHEMBL2434146 0.80 KDR (0.68) KDRFLT1FLT4RETPDGFRB
SCHEMBL2439217 0.79 KDR (0.66) KDRFLT1FLT4RETPDGFRB
SCHEMBL2709142 0.78 PTPN1 (0.45) KDRFLT1FLT4RETPDGFRB
SCHEMBL2434221 0.77 KDR (0.77) KDRFLT1FLT4RETPDGFRB
SCHEMBL2439125 0.74 KDR (0.62) KDRFLT1FLT4RETPDGFRB
SCHEMBL987105 0.74 RXFP1 (0.72) 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