SCHEMBL27433136

SCHEMBL27433136

NC(=O)c1cnc2c(F)cc(I)cc2c1O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 3/20 0.40
KCNH2 Q12809 1/20 0.35
MAP2K2 P36507 2/20 0.35
MAP2K1 Q02750 2/20 0.35
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
PARP1 P09874 3/20 0.33
MELK Q14680 2/20 0.33
MAP4K4 O95819 1/20 0.33
SLC2A1 P11166 1/20 0.32
ALOX5AP P20292 1/20 0.32
FEN1 P39748 1/20 0.32
NNMT P40261 2/20 0.32
DGAT1 O75907 1/20 0.32

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
SCHEMBL27471079 0.87 TET2 (0.40) TET2MAP2K2MAP2K1MELK
SCHEMBL6200159 0.79 MAPT (0.42) MAP2K2MAP2K1
SCHEMBL27459473 0.76 RPS6KB1 (0.38) KCNH2NR1H2NR1H3PARP1MELK
SCHEMBL8133288 0.76 NR1H2 (0.47) NR1H2NR1H3PARP1MAP4K4
SCHEMBL6200932 0.73 GAA (0.41) TET2
SCHEMBL6196896 0.72 EGLN1 (0.47)
SCHEMBL6199950 0.71 KDM4E (0.41)
Hydrochloric Acid SCHEMBL6083555 0.70 KDM4E (0.40)
SCHEMBL27486805 0.70 PSMD14 (0.46) TET2PARP1NNMT
SCHEMBL6197857 0.69 KDM4E (0.39)

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
CN-1128790-C 4-hydroxyquinoline-3-carboxamides and hydrazides as antiviral agents UPJOHN CO (US) 2003-11-26 CN disclosed
CN-1281439-A 4-hydroxyquinoline-3-carboxamide and hydrazide compounds as antiviral agents UPJOHN CO (US) 2001-01-24 CN disclosed