SCHEMBL5327417

SCHEMBL5327417

O=C(O)CC(N[C@@H](CC(=O)O)C(=O)O)C(=O)O.[Na].[Na].[Na].[Na]

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.47
CA4 P22748 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
SLC22A6 Q4U2R8 1/20 0.41
CA1 P00915 1/20 0.41
MME P08473 3/20 0.40
FOLH1 Q04609 1/20 0.39
RIMKLA Q8IXN7 1/20 0.39
NAALAD2 Q9Y3Q0 1/20 0.39
TGFBR1 P36897 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 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
SCHEMBL1419353 1.00 CA2 (0.47) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL29915534 1.00 CA2 (0.47) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL2910640 0.97 CA2 (0.48) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL1457564 0.97 CA2 (0.48) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL2916092 0.97 CA2 (0.48) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL22019 0.97 CA2 (0.48) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL786600 0.94 CA2 (0.47) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL3055923 0.94 CA2 (0.47) CA2CA4TDP1SMN1; SMN2SLC22A6
Ammonia Solution, Strong SCHEMBL4612095 0.94 TDP1 (0.52) CA2CA4TDP1SMN1; SMN2SLC22A6
SCHEMBL18419474 0.94 CA2 (0.47) CA2CA4TDP1SMN1; SMN2SLC22A6

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
WO-2007141635-A2 DETERGENTS FORMULATIONS WITH LOW IMPACT ON THE ENVIRONMENT PALLADINI SILVIA (IT) 2007-12-13 WO disclosed