SCHEMBL1957348

SCHEMBL1957348

Cc1cc(=O)c(=O)c(=O)c1=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP3A4 P08684 1/20 0.32
DBH P09172 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32
HPGD P15428 1/20 0.32
ALOX12 P18054 1/20 0.32
CRHR1 P34998 1/20 0.32
DRD3 P35462 1/20 0.32
CBS P35520 1/20 0.32
SNCA P37840 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32

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
SCHEMBL14493743 0.97
SCHEMBL791395 0.87
SCHEMBL9999337 0.71
SCHEMBL28741284 0.66
SCHEMBL30596849 0.64 NQO1 (0.31)
SCHEMBL28846241 0.63 ALDH1A1 (0.36) MEN1ALDH1A1MAPTKMT2ASMN1; SMN2
SCHEMBL3364405 0.61 GRIN2D (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12737792 0.59 CDC25A (0.33) MEN1ALDH1A1MAPTHPGDKMT2A
SCHEMBL16276536 0.58 GRIN2D (0.39) MEN1ALDH1A1CYP3A4MAPTHPGD
SCHEMBL1959323 0.55 PAX8 (0.32) ALDH1A1DBHMAPT

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
EP-2332898-A1 Benzoquinone-based antioxidants Universität des Saarlandes (DE) 2011-06-15 EP claimed
EP-2332898-A1 Benzoquinone-based antioxidants Universität des Saarlandes (DE) 2011-06-15 EP disclosed