SCHEMBL1709904

SCHEMBL1709904

Cc1nn(C(=O)OC(C)(C)C)c2cc(Nc3nc(NC4CCCC4)c4occc4n3)ccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.51
DAPK3 O43293 1/20 0.51
JAK2 O60674 1/20 0.51
STK16 O75716 1/20 0.51
MAP4K4 O95819 1/20 0.51
PAK4 O96013 1/20 0.51
ABL1 P00519 1/20 0.51
LCK P06239 1/20 0.51
FYN P06241 1/20 0.51
RET P07949 1/20 0.51
LTK P29376 1/20 0.51
TTK P33981 1/20 0.51
GRK5 P34947 1/20 0.51
KDR P35968 1/20 0.51
MAPK8 P45983 1/20 0.51
CSNK1A1 P48729 1/20 0.51
PTK2 Q05397 1/20 0.51
TYRO3 Q06418 1/20 0.51
TNK2 Q07912 1/20 0.51
MAP4K2 Q12851 1/20 0.51

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
SCHEMBL1709921 0.97 SYK (0.55) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL1709900 0.90 SYK (0.48) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3806436 0.90 SYK (0.48) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3708058 0.90 SYK (0.48) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3710386 0.85 SYK (0.60) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3707015 0.84 SYK (0.48) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3705642 0.84 SYK (0.48) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL3710968 0.83 SYK (0.50) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL1709910 0.79 ACACB (0.36) SYKDAPK3JAK2STK16MAP4K4
SCHEMBL1709801 0.77 SYK (0.35) SYKDAPK3JAK2STK16MAP4K4

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