SCHEMBL17801064

SCHEMBL17801064

N#Cc1ccc(-c2n[nH]c3ccc(Br)cc23)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DCLK1 O15075 1/20 0.65
PRKD3 O94806 1/20 0.65
MAP4K4 O95819 1/20 0.65
CHEK2 O96017 1/20 0.65
CSF1R P07333 1/20 0.65
FER P16591 1/20 0.65
CDK2 P24941 1/20 0.65
MARK3 P27448 1/20 0.65
FLT4 P35916 1/20 0.65
FLT3 P36888 1/20 0.65
MAPK9 P45984 1/20 0.65
CSNK1D P48730 1/20 0.65
CLK2 P49760 1/20 0.65
CSNK2A1 P68400 1/20 0.65
CSNK1G2 P78368 1/20 0.65
MAP4K2 Q12851 1/20 0.65
STK3 Q13188 1/20 0.65
CAMK2B Q13554 1/20 0.65
CAMK2G Q13555 1/20 0.65
DYRK1A Q13627 1/20 0.65

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
SCHEMBL1664137 0.82 LRRK2 (0.58) LRRK2AXLTRPA1SCN5ASCN9A
SCHEMBL4734012 0.80 CSNK1D (0.71) DCLK1PRKD3MAP4K4CHEK2CSF1R
SCHEMBL4316858 0.79 DCLK1 (1.00) DCLK1PRKD3MAP4K4CHEK2CSF1R
SCHEMBL2731639 0.79 FLT3 (0.75) DCLK1PRKD3MAP4K4CHEK2CSF1R
SCHEMBL2857828 0.79 LRRK2 (0.54) CSNK1DLRRK2TRPA1SCN5ASCN9A
SCHEMBL5379650 0.79 MAPK1 (0.61) LRRK2PDPK1TRPA1SCN5ASCN9A
SCHEMBL2859279 0.78 ITK (0.64) DCLK1PRKD3MAP4K4CHEK2CSF1R
SCHEMBL12317928 0.78 IDO1 (0.65) LRRK2PDPK1TRPA1SCN5ASCN9A
SCHEMBL29130516 0.77 TDO2 (0.69) HTR2B
SCHEMBL2242478 0.77 LRRK2 (0.59) LRRK2TRPA1SCN5ASCN9AMKNK1

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-2016089977-A1 SUBSTITUTED INDAZOLE COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS OF TREATMENT THEREWITH CELGENE CORPORATION (US) 2016-06-09 WO disclosed