SCHEMBL5691997

SCHEMBL5691997

O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.c1ccc(-[s+]2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.33
CA1 P00915 12/20 0.33
MMP1 P03956 5/20 0.32
MMP2 P08253 5/20 0.32
MMP9 P14780 5/20 0.32
MMP8 P22894 5/20 0.32
MMP13 P45452 5/20 0.32
PTPN1 P18031 1/20 0.31
GPR3 P46089 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
SCHEMBL5691705 0.99 CA2 (0.35) CA2CA1MMP1MMP2MMP9
SCHEMBL3289780 0.86 GPR3 (0.31) GPR3
SCHEMBL2387774 0.84 CA2 (0.36) CA2CA1MMP1MMP2MMP9
SCHEMBL5690740 0.82 CA2 (0.35) CA2CA1MMP1MMP2MMP9
SCHEMBL29869290 0.81
SCHEMBL6708360 0.80 CA2 (0.35) CA2CA1MMP1MMP2MMP9
SCHEMBL3289784 0.78
SCHEMBL2904052 0.75 CA1 (0.34) CA2CA1MMP1MMP2MMP9
SCHEMBL2901807 0.74 CA2 (0.35) CA2CA1MMP1MMP2MMP9
Trifluoromethanesulfonic Acid SCHEMBL31720859 0.74 KCNH2 (0.39) CA2CA1GPR3

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
EP-1642172-A2 COMPOSITIONS COMPRISING PHOTOACID GENERATORS AZ Electronic Materials USA Corp. (US) 2006-04-05 EP disclosed
WO-2005003858-A2 COMPOSITIONS COMPRISING PHOTOACID GENERATORS AZ ELECTRONIC MATERIALS USA CORP. (US) 2005-01-13 WO disclosed
US-20040265733-A1 Photoacid generators AZ ELECTRONIC MATERIALS USA CORP. 2004-12-30 US disclosed