SCHEMBL5872424

SCHEMBL5872424

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

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 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
SCHEMBL10127906 0.72 CA1 (0.33) CA1CA2
SCHEMBL576254 0.69 ALDH1A1 (0.35) CA1CA2MMP1MMP2MMP9
SCHEMBL3189616 0.68 MMP1 (0.34) CA1CA2MMP1MMP2MMP9
SCHEMBL2204380 0.67 CA1 (0.33) CA1CA2
SCHEMBL2058155 0.67 CA1 (0.33) CA1CA2
SCHEMBL6261329 0.67 CA2 (0.42) CA1CA2MMP1MMP2MMP9
SCHEMBL155905 0.67 MMP1 (0.40) CA1CA2MMP1MMP2MMP9
Trifluoromethanesulfonic Acid SCHEMBL1131470 0.67 ALDH1A1 (0.33)
Trifluoromethanesulfonic Acid SCHEMBL2239043 0.67 ALDH1A1 (0.33) CA1CA2MMP1MMP2MMP9
SCHEMBL31686017 0.66 CA2 (0.37) CA1CA2

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-7098282-B2 Fluorosulfone-silicone hydrogel, RGP contact lenses, optical medical devices and compositions thereof NOVICKY NICK 2006-08-29 US disclosed
US-20050176907-A1 Fluorosulfone-silicone hydrogel, RGP contact lenses, optical medical devices and compositions thereof NOVICKY NICK (CA) 2005-08-11 US disclosed
EP-1455201-A1 Fluorosulfone-silicone hydrogel RGP contact lenses, optical medical devices and compositions thereof Novicky, Nick N. (CA) 2004-09-08 EP disclosed