SCHEMBL5449389

SCHEMBL5449389

O=S(=O)(NC(F)(F)F)C(F)(F)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
MMP1 P03956 2/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
CA7 P43166 1/20 0.33
CA13 Q8N1Q1 1/20 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
SCHEMBL228558 0.81 CA2 (0.50) CA1CA2CA7CA13
SCHEMBL4552516 0.80 CA1 (0.38) CA1CA2MMP1MMP2MMP9
SCHEMBL8572931 0.79 CA2 (0.61) CA1CA2MMP1MMP2MMP9
SCHEMBL21629339 0.79 CA2 (0.48) CA1CA2CA7CA13
SCHEMBL20723413 0.79 CA2 (0.48) CA1CA2CA7CA13
SCHEMBL17292686 0.79 CA2 (0.48) CA1CA2CA7CA13
SCHEMBL671116 0.79 CA2 (0.48) CA1CA2CA7CA13
SCHEMBL20725006 0.79 CA2 (0.48) CA1CA2CA7CA13
SCHEMBL21831901 0.79 CA2 (0.48) CA1CA2CA7CA13
Lithium SCHEMBL1938818 0.78 CA1 (0.36) CA1CA2MMP1MMP2MMP9

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
JP-2007257958-A BATTERY SONY CORP 2007-10-04 JP disclosed