SCHEMBL8524309

SCHEMBL8524309

C=CCC(CS(=O)(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.50
GRIK2 Q13002 2/20 0.50
CPA1 P15085 1/20 0.48
CYP2C19 P33261 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.31
TBXAS1 P24557 1/20 0.31
GCLC P48506 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
SCHEMBL4405911 0.82 GRIK1 (0.48) GRIK1GRIK2CPA1CYP2C19TBXAS1
SCHEMBL891727 0.79 GRIK1 (0.64) GRIK1GRIK2CPA1CYP2C19TBXAS1
SCHEMBL6050002 0.77 GRIK1 (0.75) GRIK1GRIK2CPA1CYP2C19TBXAS1
SCHEMBL27575856 0.76 CA1 (0.42) GRIK1GRIK2CPA1
SCHEMBL29116998 0.74 GRIK1 (0.42) GRIK1GRIK2CPA1CYP2C19
SCHEMBL10625605 0.73
SCHEMBL28669334 0.73 SLC22A6 (0.36) SLC22A6
SCHEMBL24215021 0.71 GRIK1 (0.55) GRIK1GRIK2CPA1CYP2C19SLC22A6
SCHEMBL7114024 0.71 GRIK1 (0.55) GRIK1GRIK2CPA1CYP2C19SLC22A6
SCHEMBL88549 0.71

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-0746541-B1 TAURINE DERIVATIVES FOR USE IN CLEANSER COMPOSITIONS KAO CORP (JP) 1999-10-20 EP disclosed