SCHEMBL6916643

SCHEMBL6916643

O=S(=O)([O-])c1ccc(F)cc1.O=S(=O)([O-])c1ccc(F)cc1.O=S(=O)([O-])c1ccc(F)cc1.[Al+3]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
MMP1 P03956 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
SOS1 Q07889 1/20 0.45
F2 P00734 1/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
PKM P14618 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
PTGS2 P35354 4/20 0.42
PTGS1 P23219 1/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL1306434 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
Zinc Ion SCHEMBL6913980 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6914532 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
Silver SCHEMBL6114752 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6918587 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6912736 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6918598 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6909664 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
SCHEMBL6914789 0.94 MMP2 (0.50) MMP2CA1CA2MMP1MMP9
Lithium Ion SCHEMBL16563321 0.87 MMP2 (0.45) MMP2CA1CA2MMP1MMP9

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-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed