SCHEMBL7703549

SCHEMBL7703549

CNCCS(=O)(=O)O.[NaH].[NaH]

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
PTGS1 P23219 1/20 0.39
PDE4A P27815 1/20 0.39
SLC6A6 P31641 1/20 0.39
CYP2C19 P33261 1/20 0.39
BLM P54132 1/20 0.39
APP P05067 1/20 0.36
CYP2D6 P10635 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
EPHX1 P07099 1/20 0.32
EPHX2 P34913 1/20 0.32
CDK1 P06493 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
SCHEMBL646480 1.00
SCHEMBL167373 0.97
SCHEMBL2516126 0.97 LMNA (0.41) LMNAPTGS1PDE4ASLC6A6CYP2C19
Water SCHEMBL29100922 0.94
SCHEMBL1962785 0.94
SCHEMBL29116195 0.94
SCHEMBL1961609 0.94
SCHEMBL29398032 0.94
SCHEMBL27460007 0.94
Sulfuric Acid SCHEMBL27751317 0.94 LMNA (0.39) LMNAPTGS1PDE4ASLC6A6CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113816880-B Method for efficiently synthesizing N-methyl taurine and N-methyl sodium taurine 万华化学集团股份有限公司 2023-08-11 CN disclosed
US-6352965-B1 TRANSPARENT SOLIDS DETERGENTS OF FATTY ACID SALTS SHISEIDO CO., LTD. (JP) 2002-03-05 US disclosed
EP-1057888-A2 Transparent solid detergent composition SHISEIDO HONEY-CAKE INDUSTRY CO., LTD. (JP) 2000-12-06 EP disclosed