SCHEMBL6004735

SCHEMBL6004735

Fc1cc2nccc(Cl)c2c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.33
PDE4B Q07343 2/20 0.32
PDE4D Q08499 1/20 0.32
EPHB4 P54760 1/20 0.31
LRRK2 Q5S007 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK10 P53779 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NR4A2 P43354 2/20 0.31
SOS2 Q07890 1/20 0.31
MAPT P10636 1/20 0.31
AURKA O14965 1/20 0.30
AURKB Q96GD4 1/20 0.30
CASP6 P55212 1/20 0.30

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
SCHEMBL29622975 0.77 AAK1 (0.40) KMOEPHB4LRRK2
SCHEMBL4758327 0.77 AAK1 (0.40) KMOEPHB4LRRK2
SCHEMBL6473651 0.74 CYP1A2 (0.34) KMOEPHB4
SCHEMBL4655567 0.72 AXL (0.42) KMOALOX15HSD17B10NR4A2SOS2
SCHEMBL15056561 0.72 CYP17A1 (0.38) LRRK2ALDH1A1ALOX15HSD17B10NR4A2
SCHEMBL15578362 0.72 LRRK2 (0.30) LRRK2ALDH1A1ALOX15HSD17B10NR4A2
SCHEMBL9984695 0.71 PARP1 (0.44) PDE4BPDE4DALDH1A1ALOX15HSD17B10
SCHEMBL6033046 0.70 AAK1 (0.32)
SCHEMBL1556897 0.69 NR4A2 (0.44) ALDH1A1ALOX15HSD17B10NR4A2SOS2
SCHEMBL30800065 0.69 NR4A2 (0.44) ALDH1A1ALOX15HSD17B10NR4A2SOS2

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
EP-1724268-A1 COMPOUND HAVING TGF-BETA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-22 EP disclosed