SCHEMBL3867200

SCHEMBL3867200

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1-n1c(CCN2CCOCC2)c2cnc(N)nc2nc1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 3/20 0.56
TNK2 Q07912 3/20 0.56
MAP4K2 Q12851 3/20 0.56
ABL1 P00519 1/20 0.56
FES P07332 1/20 0.56
RET P07949 1/20 0.56
PDGFRB P09619 1/20 0.56
KIT P10721 1/20 0.56
FGFR1 P11362 1/20 0.56
SRC P12931 1/20 0.56
PDGFRA P16234 1/20 0.56
FLT1 P17948 1/20 0.56
FGFR3 P22607 1/20 0.56
EPHA3 P29320 1/20 0.56
KDR P35968 1/20 0.56
BMX P51813 1/20 0.56
EPHB4 P54760 1/20 0.56
TEK Q02763 1/20 0.56
KARS1 Q15046 1/20 0.56
NTRK3 Q16288 1/20 0.56

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
SCHEMBL3824942 0.92 LCK (0.57) LCKTNK2MAP4K2SRCKDR
SCHEMBL3824576 0.84 TNK2 (0.63) LCKTNK2MAP4K2ABL1FES
SCHEMBL3829420 0.83 LCK (0.55) LCKTNK2MAP4K2ABL1SRC
SCHEMBL3832093 0.82 SRC (0.54) LCKTNK2MAP4K2ABL1SRC
SCHEMBL3824938 0.81 LCK (0.52) LCKTNK2MAP4K2ABL1SRC
SCHEMBL3831868 0.80 RAF1 (0.59) RAF1BRAF
SCHEMBL3135890 0.80 TNK2 (0.76) LCKTNK2MAP4K2ABL1FES
SCHEMBL3827892 0.79 TNK2 (0.56) LCKTNK2MAP4K2ABL1FES
SCHEMBL3825076 0.79 LCK (0.49) LCKSRCKDRMAPK14RAF1
SCHEMBL3832068 0.78 LCK (0.49) LCKSRCKDRMAPK14RAF1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651648-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-02 EP claimed
JP-2007500725-A 2007-01-18 JP claimed
EP-1651648-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-03 EP claimed
WO-2005011597-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-02-10 WO claimed