SCHEMBL6669939

SCHEMBL6669939

CC(C)n1[c]nc2cc(Cl)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
THRB P10828 1/20 0.41
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 1/20 0.35
FGFR1 P11362 1/20 0.35
CHEK1 O14757 1/20 0.35
LIMK1 P53667 1/20 0.35
MAPK14 Q16539 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
FABP4 P15090 1/20 0.34
BACE1 P56817 3/20 0.34
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
PTPN1 P18031 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HCRTR1 O43613 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33

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
SCHEMBL17186982 0.79 HTR2C (0.35) MAPTKMT2AMEN1HTR2AHTR2C
SCHEMBL1099044 0.77 KMT2A (0.41) MAPTKMT2AFGFR1CHEK1LIMK1
SCHEMBL1831523 0.74 ALDH1A1 (0.42) MAPTKMT2ATDP1MEN1HTT
SCHEMBL8775921 0.74 MAPT (0.45) MAPTTHRBKMT2ATDP1FABP4
SCHEMBL11430315 0.72 MAPT (0.39) MAPTKMT2ATDP1FGFR1CHEK1
SCHEMBL3987798 0.68 MAPT (0.43) MAPTTHRBKMT2ATDP1FABP4
SCHEMBL3713957 0.67 KCNMA1 (0.39) KMT2ABACE1
SCHEMBL20665086 0.67 HCAR3 (0.58) MAPTTHRBKMT2AFGFR1FABP4
SCHEMBL13677265 0.66 BACE1 (0.44) MAPTTHRBKMT2ATDP1BACE1
SCHEMBL13676924 0.66 MAPT (0.41) MAPTTHRBKMT2ATDP1CHEK1

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-1141021-B1 REMOVAL/PURIFICATION OF SERUM ALBUMINS AMERSHAM BIOSCIENCES AB (SE) 2004-09-08 EP disclosed