SCHEMBL13645018

SCHEMBL13645018

O=C(O)CN(CC(=O)O)c1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.46
CAMK2A Q9UQM7 1/20 0.46
CYP1A1 P04798 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA3 P07451 1/20 0.41
TYR P14679 1/20 0.41
DRD1 P21728 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
TDP1 Q9NUW8 1/20 0.39
ESRRG P62508 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38

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
SCHEMBL28538693 0.91 CA2 (0.43) CA2CAMK2ACYP1A1CA12CA1
SCHEMBL8038936 0.91 TDP1 (0.44) DRD1TDP1ALDH1A1LMNAMAPT
SCHEMBL13644973 0.90 CA2 (0.42) CA2CAMK2ACYP1A1CA12CA1
SCHEMBL8483627 0.88 ESRRG (0.48) CA2CAMK2ATDP1ESRRGALDH1A1
SCHEMBL13645000 0.86 CYP1A1 (0.41) CA2CAMK2ACYP1A1ESRRGALDH1A1
SCHEMBL13603850 0.86 ALDH1A1 (0.40) CA2CAMK2ACYP1A1CA12CA1
SCHEMBL2985103 0.83 CA2 (0.37) CA2CAMK2ACYP1A1CA12CA1
SCHEMBL13644980 0.83 CA1 (0.50) CA2CYP1A1CA1MAPTPOLB
SCHEMBL11297196 0.82 CA2 (0.46) CA2CAMK2ACYP1A1CA12CA1
SCHEMBL13644956 0.82 SMN1; SMN2 (0.43) CA2CAMK2ACA1TDP1ALDH1A1

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
US-20090246700-A1 PLATE-MAKING METHOD OF LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
US-20090246700-A1 PLATE-MAKING METHOD OF LITHOGRAPHIC PRINTING PLATE PRECURSOR FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed