SCHEMBL8958850

SCHEMBL8958850

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

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.37
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL7082097 0.73 FOLH1 (0.39) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL2058534 0.72 FOLH1 (0.38) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL5364841 0.71 FOLH1 (0.41) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL22379 0.70 FOLH1 (0.37) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL11340658 0.69 FOLH1 (0.36) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL11341379 0.68 FOLH1 (0.38) FOLH1CA2CA4TDP1SMN1; SMN2
SCHEMBL11343035 0.67 FOLH1 (0.38) FOLH1CA2CA4
SCHEMBL11331189 0.66 FDPS (0.39) FOLH1CA2CA4TDP1
SCHEMBL3282741 0.65 SLC22A6 (0.43) FOLH1TDP1SMN1; SMN2
SCHEMBL11196284 0.65 TDP1 (0.42) FOLH1TDP1SMN1; SMN2

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
EP-0364067-B1 High-carbonate automatic dishwashing detergent with decreased calcium salt deposition CLOROX CO (US) 1996-01-24 EP disclosed