SCHEMBL27465083

SCHEMBL27465083

C=C(C(CC(=O)O)C(=O)O)C(CC(=O)O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
SLC22A6 Q4U2R8 1/20 0.43
TET2 Q6N021 3/20 0.39
FOLH1 Q04609 2/20 0.39
TET3 O43151 1/20 0.39
TET1 Q8NFU7 1/20 0.39
GRIK1 P39086 1/20 0.37
GRIK2 Q13002 1/20 0.37
GRM1 Q13255 1/20 0.37
GRM2 Q14416 1/20 0.37
GABRR1 P24046 2/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.35
CPA1 P15085 2/20 0.32
CPB1 P15086 1/20 0.32
CPA3 P15088 1/20 0.32
CPB2 Q96IY4 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
SCHEMBL110197 0.81 TDP1 (0.59) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL5221301 0.78 TDP1 (0.43) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL28497300 0.78 TDP1 (0.43) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL78919 0.78 TDP1 (0.43) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL5681439 0.78 TDP1 (0.56) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL1472841 0.78 TDP1 (0.56) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL3110310 0.75 TDP1 (0.53) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL27653781 0.74 TDP1 (0.40) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL16652346 0.71 FFAR3 (0.38) TDP1SMN1; SMN2SLC22A6TET2FOLH1
SCHEMBL10734056 0.71 HDAC1 (0.44) TDP1SMN1; SMN2SLC22A6FOLH1TSHR

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
CN-1081672-A carboxylic acid derivative and preparation method thereof NIPPON SHINYAKU CO LTD (JP) 1994-02-09 CN disclosed