SCHEMBL8948818

SCHEMBL8948818

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

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
SLC22A6 Q4U2R8 1/20 0.39
GABRR1 P24046 2/20 0.33
LMNA P02545 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
MAPT P10636 1/20 0.30

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
SCHEMBL8948813 0.83
SCHEMBL9782235 0.81 SMN1; SMN2 (0.44) SMN1; SMN2SLC22A6GABRR1LMNATDP1
SCHEMBL8948858 0.79 CA4 (0.50)
SCHEMBL9752586 0.77 OR51E2 (0.40)
SCHEMBL27940698 0.77 SLC22A6 (0.32) SMN1; SMN2SLC22A6TDP1
SCHEMBL180343 0.74 SMN1; SMN2 (0.57) SMN1; SMN2SLC22A6GABRR1LMNATDP1
SCHEMBL11041786 0.74 MMP2 (0.34) SLC22A6
Malic Acid SCHEMBL29048431 0.72 SMN1; SMN2 (0.62) SMN1; SMN2SLC22A6TDP1
SCHEMBL8814451 0.72 SMN1; SMN2 (0.41) SMN1; SMN2GABRR1LMNA
SCHEMBL8598450 0.72

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-5488146-A SULFONATING MALEIC ANHYDRIDE WITH SULFUR TRIOXIDE; ADDING GLYCOLIC ACID; SALT FORMATION WITH ALKALINE EARTH OR ALKALI METAL HYDROXIDE; PRECIPITATING; ION EXCHANGING WITH SODIUM SALT LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1996-01-30 US disclosed