SCHEMBL5332500

SCHEMBL5332500

NC(=O)Nc1ccccc(=O)c1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
KDM4E B2RXH2 1/20 0.50
DBH P09172 2/20 0.46
TOP1 P11387 2/20 0.44
TOP2A P11388 1/20 0.44
TOP2B Q02880 1/20 0.44
MAPT P10636 1/20 0.42
GFER P55789 1/20 0.42
ALDH1A1 P00352 2/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PEPD P12955 1/20 0.42
POLB P06746 1/20 0.42
CYP1A2 P05177 1/20 0.42
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
TERT O14746 1/20 0.39
CXCR1 P25024 1/20 0.39

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
SCHEMBL7256165 0.85 GAA (0.61) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL3928666 0.82 GAA (0.67) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL29840068 0.82 GAA (0.67) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL15259585 0.78 KDM4E (0.57) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL3859948 0.76 GAA (0.61) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL29807803 0.76 GAA (0.61) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL5332499 0.75 GAA (0.50) GAAKDM4ETOP1TOP2ATOP2B
SCHEMBL7417077 0.73 GAA (0.57) GAAKDM4EMAPTGFERALDH1A1
SCHEMBL11649214 0.71 GAA (0.61) GAAKDM4EMAPTGFERALDH1A1
SCHEMBL11760578 0.71 GAA (0.61) GAAKDM4ETOP1TOP2ATOP2B

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
JP-2007145723-A UREIDO TROPOLONE DERIVATIVE RESEARCH FOUNDATION ITSUU LABORATORY 2007-06-14 JP disclosed