SCHEMBL9213672

SCHEMBL9213672

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

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.36
FOLH1 Q04609 2/20 0.33
HDAC2 Q92769 1/20 0.31
GABRR1 P24046 2/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL9224559 0.85 TDP1 (0.52) TDP1SMN1; SMN2SLC22A6FOLH1
SCHEMBL8815410 0.79 TDP1 (0.56) TDP1SMN1; SMN2SLC22A6FOLH1HDAC2
SCHEMBL2864190 0.79 TDP1 (0.56) TDP1SMN1; SMN2SLC22A6FOLH1HDAC2
SCHEMBL4824737 0.78 TDP1 (0.45) TDP1SMN1; SMN2
Formic Acid SCHEMBL20836208 0.77 TDP1 (0.78) TDP1SMN1; SMN2SLC22A6FOLH1HDAC2
SCHEMBL9911939 0.76 TDP1 (0.59) TDP1SMN1; SMN2SLC22A6FOLH1HDAC2
SCHEMBL17517216 0.76 TDP1 (1.00) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL22151 0.76 TDP1 (1.00) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL16925719 0.76 TDP1 (1.00) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1
SCHEMBL165643 0.76 TDP1 (1.00) TDP1SMN1; SMN2SLC22A6FOLH1GABRR1

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
US-5424165-A Printing durability, storage stability FUJI PHOTO FILM CO., LTD. (JP) 1995-06-13 US disclosed