SCHEMBL8015117

SCHEMBL8015117

CN(C(N)=O)S(=O)(=O)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.34
PRSS1 P07477 3/20 0.34
PRSS2 P07478 3/20 0.34
PRSS3 P35030 3/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA13 Q8N1Q1 1/20 0.33

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
SCHEMBL11336394 0.80 CA1 (0.31) CA1CA2CA7CA13
SCHEMBL25756691 0.80 CA1 (0.31) CA1CA2CA7CA13
SCHEMBL1703393 0.76 CHRM2 (0.32)
SCHEMBL3974868 0.74
SCHEMBL6288984 0.73
SCHEMBL16531875 0.73
SCHEMBL8529261 0.72
SCHEMBL6047417 0.70 CA1 (0.38) CA1CA2
SCHEMBL21065967 0.70 F2 (0.33) F2PRSS1PRSS2PRSS3CA1
SCHEMBL24465429 0.69 CA1 (0.40) CA1CA2CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0971854-A1 NOVEL MATERIALS USEFUL AS ELECTROLYTIC SOLUTES ACEP INC. (CA) 2000-01-19 EP disclosed
WO-1999040025-A1 NOVEL MATERIALS USEFUL AS ELECTROLYTIC SOLUTES ACEP INC. (CA) 1999-08-12 WO disclosed
EP-0890176-A1 PROTON CONDUCTOR IN LIQUID FORM HYDRO-QUEBEC (CA) 1999-01-13 EP disclosed
WO-1998029877-A1 PROTON CONDUCTOR IN LIQUID FORM HYDRO-QUEBEC (CA) 1998-07-09 WO disclosed