SCHEMBL17469882

SCHEMBL17469882

O=S(=O)(O)OCC(F)(F)COS(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
CA9 Q16790 1/20 0.39
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL17456442 0.97 CA2 (0.37) CA2CA1CA9TSHRTDP1
SCHEMBL27202266 0.87 CA1 (0.34) CA2CA1CA9TSHRTDP1
SCHEMBL17466289 0.85 CA1 (0.30) CA2CA1CA9
SCHEMBL27202270 0.84 CA1 (0.32) CA2CA1CA9
SCHEMBL2293100 0.83 CA2 (0.56) CA2CA1CA9TSHRTDP1
SCHEMBL17469735 0.83 CA2 (0.39) CA2CA1CA9TSHRTDP1
SCHEMBL17456425 0.81 CA2 (0.54) CA2CA1CA9TSHRTDP1
SCHEMBL17456517 0.81 CA2 (0.54) CA2CA1CA9TSHRTDP1
SCHEMBL17456378 0.81 CA2 (0.37) CA2CA1CA9TSHRTDP1
SCHEMBL27202255 0.80 CA1 (0.30) CA2CA1CA9

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-20160027592-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE USING SAME UBE INDUSTRIES, LTD. (JP) 2016-01-28 US disclosed