SCHEMBL9398166

SCHEMBL9398166

FC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(F)F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.37
MMP1 P03956 2/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
F2 P00734 2/20 0.33
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL202580 0.90 KDM4E (0.38) CA2CA1MMP1MMP2MMP9
Sulfamide SCHEMBL4938226 0.88 CA2 (0.38) CA2CA1MMP1MMP2MMP9
Sulfamide SCHEMBL4937407 0.88 CA2 (0.38) CA2CA1MMP1MMP2MMP9
SCHEMBL9681471 0.88 CA2 (0.38) CA2CA1MMP1MMP2MMP9
SCHEMBL817265 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB
SCHEMBL817697 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB
SCHEMBL815543 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB
SCHEMBL506073 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB
SCHEMBL506811 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB
SCHEMBL64077 0.87 LMNA (0.40) CA2KDM4ETSHRTDP1THRB

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-5366597-A Process for the preparation of perfluorobutylsulphonyl fluoride BAYER AG (DE) 1994-11-22 US disclosed