SCHEMBL1709928

SCHEMBL1709928

NCc1ccc(Nc2nc(NC3CC3)c3occc3n2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.58
JAK2 O60674 3/20 0.58
ABL1 P00519 3/20 0.58
LCK P06239 3/20 0.58
FYN P06241 3/20 0.58
RET P07949 3/20 0.58
MAPK8 P45983 3/20 0.58
TNK2 Q07912 3/20 0.58
MAP4K2 Q12851 3/20 0.58
DAPK3 O43293 2/20 0.58
PAK4 O96013 2/20 0.58
LTK P29376 2/20 0.58
GRK5 P34947 2/20 0.58
CSNK1A1 P48729 2/20 0.58
TYRO3 Q06418 2/20 0.58
ALK Q9UM73 2/20 0.58
TTK P33981 2/20 0.58
STK16 O75716 1/20 0.58
MAP4K4 O95819 1/20 0.58
KDR P35968 1/20 0.58

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
SCHEMBL1709923 0.87 SYK (0.61) SYKJAK2ABL1LCKFYN
SCHEMBL3704057 0.85 SYK (0.55) SYKJAK2ABL1LCKFYN
SCHEMBL1709820 0.82 SYK (0.52) SYKJAK2ABL1LCKFYN
SCHEMBL1709847 0.82 SYK (0.58) SYKJAK2ABL1LCKFYN
SCHEMBL1709757 0.82 SYK (0.56) SYKJAK2ABL1LCKFYN
SCHEMBL1709925 0.81 SYK (0.58) SYKJAK2ABL1LCKFYN
SCHEMBL1709924 0.81 MERTK (0.68) SYKJAK2ABL1LCKFYN
SCHEMBL3711035 0.81 SYK (0.58) SYKJAK2ABL1LCKFYN
SCHEMBL3708975 0.80 SYK (0.56) SYKJAK2ABL1LCKFYN
SCHEMBL3700980 0.80 SYK (0.56) SYKJAK2ABL1LCKFYN

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
WO-2012048222-A1 FURO[3,2-d]PYRIMIDINE COMPOUNDS ABBOTT LABORATORIES (US) 2012-04-12 WO disclosed