SCHEMBL5503471

SCHEMBL5503471

CC(C)(C)N1C(=O)C([Fe])c2cc(N)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.36
AURKA O14965 1/20 0.36
DAPK3 O43293 1/20 0.36
JAK2 O60674 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
PAK4 O96013 1/20 0.36
ABL1 P00519 1/20 0.36
NTRK1 P04629 1/20 0.36
LCK P06239 1/20 0.36
FYN P06241 1/20 0.36
CSF1R P07333 1/20 0.36
RET P07949 1/20 0.36
IGF1R P08069 1/20 0.36
MET P08581 1/20 0.36
PDGFRB P09619 1/20 0.36
PIM1 P11309 1/20 0.36
FGFR1 P11362 1/20 0.36
PDGFRA P16234 1/20 0.36
PRKACA P17612 1/20 0.36

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
SCHEMBL5506950 0.79 CHEK1 (0.50) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL5505355 0.73 CYP19A1 (0.43) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL5998058 0.65 ATAD2 (0.45) ATAD2KDM4EMEN1ALDH1A1LMNA
SCHEMBL5503465 0.64 ATAD2 (0.44) ATAD2KDM4EMEN1ALDH1A1LMNA
SCHEMBL16376952 0.60 AADAT (0.36) KDM4EMEN1ALDH1A1LMNAKMT2A
SCHEMBL19702960 0.57 HSD17B10 (0.42) MEN1ALDH1A1MAPTKMT2A
SCHEMBL31469987 0.57 CHEK1 (0.47) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL6765366 0.57 CHEK1 (0.44) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL3424164 0.54 ALDH1A1 (0.68) CA12CA1CA9ATAD2KDM4E
SCHEMBL30032581 0.54 ALDH1A1 (0.68) CA12CA1CA9ATAD2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1781642-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS Pharmacia & Upjohn Company LLC (US) 2007-05-09 EP disclosed
WO-2006016221-A1 OXAZOLIDINONES CONTAINING OXINDOLES AS ANTIBACTERIAL AGENTS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-02-16 WO disclosed