SCHEMBL5336030

SCHEMBL5336030

Cc1cc(CO)nn1-c1ccc(F)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
POLB P06746 1/20 0.64
SLC34A1 Q06495 1/20 0.45
NR3C2 P08235 1/20 0.43
PTGS2 P35354 3/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
CA9 Q16790 3/20 0.42
RIPK1 Q13546 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
NTRK1 P04629 1/20 0.41
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL15832409 0.85 MAPT (0.47) MAPTPOLBSLC34A1NR3C2PTGS2
SCHEMBL16804455 0.83 MAPT (0.63) MAPTPOLBPTGS2CA1CA2
SCHEMBL16210657 0.83 POLB (0.59) MAPTPOLBPTGS2CA1CA2
SCHEMBL17112717 0.80 NPC1 (0.50) MAPTPOLBNR3C2PTGS2CA1
SCHEMBL27759445 0.79 CA1 (0.67) NR3C2PTGS2CA1CA2CA9
SCHEMBL12462094 0.79 NR3C2 (0.59) NR3C2PTGS2CA1CA2CA9
SCHEMBL1740586 0.78 POLB (0.57) MAPTPOLBSIGMAR1
SCHEMBL4515430 0.77 MAPT (0.60) MAPTPOLBSLC34A1MAPK1HTT
SCHEMBL1739906 0.76 POLB (0.56) MAPTPOLBPTGS2CA1CA2
SCHEMBL27637349 0.74 NR3C2 (0.52) NR3C2PTGS2CA1CA2CA9

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-2007079086-A1 PYRAZOLOALKYL SUBSTITUTED IMIDAZO RING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-07-12 WO disclosed