SCHEMBL8199899

SCHEMBL8199899

CCCCOc1ccc(S(=O)(=O)N2C[C@H](O)C[C@@H]2C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 16/20 0.61
MMP3 P08254 16/20 0.61
MMP7 P09237 18/20 0.58
MMP13 P45452 12/20 0.58
MMP2 P08253 6/20 0.58
MMP9 P14780 1/20 0.52

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
SCHEMBL8199903 1.00 MMP1 (0.61) MMP1MMP3MMP7MMP13MMP2
SCHEMBL5792710 0.87 MMP1 (0.56) MMP1MMP3MMP7MMP13MMP2
SCHEMBL5789547 0.87 MMP1 (0.56) MMP1MMP3MMP7MMP13MMP2
Hydroxyamine SCHEMBL5789553 0.85 MMP1 (0.55) MMP1MMP3MMP7MMP13MMP2
SCHEMBL8210480 0.84 CA12 (0.61) MMP1MMP3MMP7MMP13MMP2
SCHEMBL8210485 0.84 CA12 (0.61) MMP1MMP3MMP7MMP13MMP2
SCHEMBL8207986 0.82 MMP3 (0.53) MMP1MMP3MMP7MMP13MMP2
SCHEMBL31086918 0.81 L3MBTL1 (0.62) MMP1MMP3MMP7MMP13MMP2
SCHEMBL8198983 0.80 ALDH1A1 (0.62) MMP1MMP3MMP7MMP13MMP2
SCHEMBL9379038 0.80 POLB (0.58) MMP1MMP2

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
US-6121272-A Bidentate metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY (US) 2000-09-19 US disclosed