SCHEMBL17435877

SCHEMBL17435877

CCN(CC)CC.O=S(=O)(F)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
EPHX1 P07099 1/20 0.37
PPIP5K2 O43314 1/20 0.33
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2348977 0.89 EPHX1 (0.41) CA1CA2EPHX1PPIP5K2MAPK1
SCHEMBL2352685 0.89 EPHX1 (0.41) CA1CA2EPHX1PPIP5K2MAPK1
SCHEMBL17435851 0.88 CA1 (0.32) CA1CA2EPHX1PPIP5K2
Trimethylammonium SCHEMBL17435850 0.82 CA1 (0.46) CA1CA2EPHX1MAPK1SMN1; SMN2
SCHEMBL17435905 0.82
SCHEMBL278189 0.82 CA2 (0.55) CA1CA2EPHX1MAPK1SMN1; SMN2
Diethylamine SCHEMBL17435827 0.81 CA1 (0.41) CA1CA2EPHX1MAPK1SMN1; SMN2
Dimethylamine SCHEMBL17435944 0.80 CA1 (0.48) CA1CA2EPHX1MAPK1SMN1; SMN2
SCHEMBL2230683 0.79 CA2 (0.52) CA1CA2EPHX1MAPK1SMN1; SMN2
SCHEMBL2230987 0.79 CA2 (0.52) CA1CA2EPHX1MAPK1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9950929-B2 Method for producing disulfonylamine alkali metal salt NIPPON SODA CO., LTD. (JP) 2018-04-24 US disclosed
EP-2977349-A1 METHOD FOR PRODUCING DISULFONYLAMINE ALKALI METAL SALT Nippon Soda Co., Ltd. (JP) 2016-01-27 EP disclosed
US-20160016797-A1 METHOD FOR PRODUCING DISULFONYLAMINE ALKALI METAL SALT NIPPON SODA CO., LTD. (JP) 2016-01-21 US disclosed