SCHEMBL9515047

SCHEMBL9515047

CNc1nc2[nH]c(=O)[nH]c(=O)c2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
ADORA2B P29275 2/20 0.46
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
GDA Q9Y2T3 3/20 0.41
ACHE P22303 1/20 0.41
XDH P47989 4/20 0.40
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 3/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
RPS6KA3 P51812 1/20 0.35
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 2/20 0.34
BLM P54132 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
PABPC1 P11940 1/20 0.34

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
SCHEMBL10997 0.75 MAPT (0.53) MAPTADORA2BGDAACHEXDH
SCHEMBL4128821 0.73 XDH (0.56) MAPTXDHGAA
SCHEMBL9669011 0.72 MAPT (0.46) MAPTADORA2BGDAACHEXDH
SCHEMBL29737686 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
SCHEMBL2837685 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
SCHEMBL932609 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
SCHEMBL740931 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
Uric Acid SCHEMBL28407297 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
Uric Acid SCHEMBL30269772 0.71 MAPT (0.53) MAPTADORA2BGDAACHEXDH
SCHEMBL30537976 0.71 ALDH1A1 (0.60) MAPTADORA2BGDAACHEXDH

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
JP-5156033-A None JP disclosed
JP-H05156033-A PR0DUCTION OF CROSSLINKED POLYOLEFIN MOLDING MITSUI TOATSU CHEM INC 1993-06-22 JP disclosed