SCHEMBL8947839

SCHEMBL8947839

CCN(C(C)OP(=O)(O)OC(C)N(CC)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 10/20 0.38
MMP2 P08253 10/20 0.38
MMP9 P14780 10/20 0.38
MMP8 P22894 10/20 0.38
MMP13 P45452 10/20 0.38
CA2 P00918 8/20 0.38
CA1 P00915 7/20 0.38
F2 P00734 3/20 0.33
PRSS1 P07477 3/20 0.33
PRSS2 P07478 3/20 0.33
PRSS3 P35030 3/20 0.33

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
Ammonia Solution, Strong SCHEMBL8015450 0.99 MMP1 (0.37) MMP1MMP2MMP9MMP8MMP13
Lithium Ion SCHEMBL8016104 0.85 MMP1 (0.35) MMP1MMP2MMP9MMP8MMP13
SCHEMBL8019961 0.85 MMP1 (0.35) MMP1MMP2MMP9MMP8MMP13
SCHEMBL10506021 0.78 MMP1 (0.43) MMP1MMP2MMP9MMP8MMP13
SCHEMBL5024952 0.75 MMP1 (0.40) MMP1MMP2MMP9MMP8MMP13
SCHEMBL2744930 0.75 MMP1 (0.40) MMP1MMP2MMP9MMP8MMP13
SCHEMBL11339890 0.71 MMP1 (0.38) MMP1MMP2MMP9MMP8MMP13
SCHEMBL6259411 0.71 MMP1 (0.46) MMP1MMP2MMP9MMP8MMP13
SCHEMBL313110 0.71 MMP1 (0.39) MMP1MMP2MMP9MMP8MMP13
SCHEMBL8947843 0.71 F2 (0.33) MMP1MMP2MMP9MMP8MMP13

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-5558940-A Oil- and water-repellent papers, processes for their production and new fluorine-containing copolymers for this purpose BAYER AKTIENGESELLSCHAFT (DE) 1996-09-24 US disclosed
EP-0102240-B1 METHOD FOR TREATING METALLIC OR CERAMIC SURFACES AT HIGH TEMPERATURES TEIJIN LIMITED (JP) 1990-10-31 EP disclosed
US-4497720-A LUBRICATING WITH MIXTURE OF POLYETHER AND A FLUORINE-CONTAINING SURFACTANT; ANTISLUDGING AGENTS; TEXTILES TEIJIN LIMITED (JP) 1985-02-05 US disclosed