SCHEMBL8314488

SCHEMBL8314488

CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(Oc3ccccn3)cc2)[C@@H](C(=O)NO)C1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 18/20 0.71
MMP9 P14780 15/20 0.71
MMP3 P08254 14/20 0.71
MMP7 P09237 13/20 0.71
MMP13 P45452 16/20 0.64
ADAM17 P78536 3/20 0.59

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
SCHEMBL6278385 1.00 MMP1 (0.71) MMP1MMP9MMP3MMP7MMP13
SCHEMBL6808240 0.87 MMP1 (0.59) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7762105 0.85 MMP1 (0.80) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7341460 0.85 MMP1 (0.80) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7340402 0.84 MMP1 (0.73) MMP1MMP9MMP3MMP7MMP13
SCHEMBL7375954 0.84 MMP1 (0.79) MMP1MMP9MMP3MMP7MMP13
SCHEMBL6336332 0.84 MMP1 (0.79) MMP1MMP9MMP3MMP7MMP13
SCHEMBL6338561 0.84 MMP1 (0.79) MMP1MMP9MMP3MMP7MMP13
SCHEMBL6266281 0.81 MMP1 (0.75) MMP1MMP9MMP3MMP7MMP13
SCHEMBL3943938 0.79 MMP13 (0.90) MMP1MMP9MMP3MMP7MMP13

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-2004073599-A2 INHIBITORS OF HEPATITIS C VIRUS, COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2004-09-02 WO disclosed