SCHEMBL3944754

SCHEMBL3944754

O=S(=O)([O-])C(F)(C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)O.c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.32
HSD11B1 P28845 1/20 0.32
GPR3 P46089 1/20 0.32
CA1 P00915 2/20 0.30
CA2 P00918 2/20 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
SCHEMBL220146 1.00 PTPN1 (0.32) PTPN1HSD11B1GPR3CA1CA2
SCHEMBL217001 0.92 GPR3 (0.36) PTPN1HSD11B1GPR3CA1CA2
SCHEMBL2443803 0.89 PTPN1 (0.34) PTPN1HSD11B1GPR3CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL3413691 0.84 GPR3 (0.37) PTPN1HSD11B1GPR3CA1CA2
SCHEMBL4801237 0.84 CA1 (0.35) PTPN1HSD11B1GPR3CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL2985949 0.82 GPR3 (0.35) PTPN1HSD11B1GPR3CA1CA2
SCHEMBL51399 0.81 CA2 (0.38) PTPN1GPR3CA1CA2MMP1
SCHEMBL1360857 0.81 CA2 (0.38) PTPN1CA1CA2MMP1MMP2
SCHEMBL1482705 0.81 CA2 (0.38) PTPN1GPR3CA1CA2MMP1
Trifluoromethanesulfonic Acid SCHEMBL3249775 0.80 GPR3 (0.44) PTPN1HSD11B1GPR3CA1CA2

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
WO-2009019574-A1 PHOTORESIST COMPOSITION FOR DEEP UV AND PROCESS THEREOF AZ ELECTRONIC MATERIALS USA CORP. (DE) 2009-02-12 WO disclosed