SCHEMBL9725300

SCHEMBL9725300

NC(C(=O)O)C(CO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
SLCO1B1 Q9Y6L6 1/20 0.50
SLC1A1 P43005 10/20 0.48
SLC1A3 P43003 7/20 0.48
SLC1A2 P43004 7/20 0.48
GLO1 Q04760 1/20 0.45
SLC7A5 Q01650 1/20 0.43
OR51E2 Q9H255 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PTGS1 P23219 1/20 0.36
SLC7A11 Q9UPY5 1/20 0.36

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
SCHEMBL3901335 0.78 TDP1 (0.50) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL30626325 0.76 GLO1 (0.48) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL1519623 0.76 TDP1 (0.65) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL2774681 0.76 TDP1 (0.65) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL8982021 0.76 GLO1 (0.48) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL19525723 0.76 GLO1 (0.48) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL4902637 0.76 GLO1 (0.48) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL27681307 0.76
SCHEMBL7272045 0.75 SLC1A1 (0.47) USP2SLCO1B1SLC1A1SLC1A3SLC1A2
SCHEMBL5302678 0.75 SLC1A1 (0.47) USP2SLCO1B1SLC1A1SLC1A3SLC1A2

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-4334377-A None JP disclosed
JP-H04334377-A ACID-LABILE LINKER MOLECULE AKZO NV 1992-11-20 JP disclosed