SCHEMBL7599063

SCHEMBL7599063

CC1(C)OC[C@H](C(O)CS(=O)(=O)c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2)O1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 20/20 0.72
MMP2 P08253 18/20 0.72
MMP1 P03956 8/20 0.72
MMP3 P08254 1/20 0.72
MMP7 P09237 1/20 0.72
MMP8 P22894 1/20 0.72
MMP13 P45452 1/20 0.72
MMP14 P50281 1/20 0.47

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
SCHEMBL7599348 1.00 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7595722 1.00 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7599560 1.00 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7595612 1.00 MMP9 (0.72) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7599342 0.89 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7599558 0.89 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7595608 0.89 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7595716 0.89 MMP9 (0.70) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7599805 0.88 MMP9 (0.73) MMP9MMP2MMP1MMP3MMP7
SCHEMBL7600748 0.88 MMP9 (0.73) MMP9MMP2MMP1MMP3MMP7

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020128496-A1 Process for the preparation of matrix metalloproteinase inhibitors ABBOTT LABORATORIES 2002-09-12 US disclosed
US-6350902-B2 REACTING HYDROXYAMINE WITH A TRIFLUOROFORMATE ESTER ABBOTT LABORATORIES 2002-02-26 US disclosed
US-20020002307-A1 Process for the selective N-formylation of N-hydroxylamines ABBOTT LABORATORIES 2002-01-03 US disclosed
US-20010031896-A1 Process for the selective N-formylation of N-hydroxylamines ABBOTT LABORATORIES 2001-10-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010031896-A1 Process for the selective N-formylation of N-hydroxylamines HNMT, INMT, PNMT MMP9 2786/4885MMP2 3410/4885MMP1 3507/4885
US-20020002307-A1 Process for the selective N-formylation of N-hydroxylamines HNMT, INMT, PNMT MMP9 2786/4885MMP2 3410/4885MMP1 3507/4885
US-20020128496-A1 Process for the preparation of matrix metalloproteinase inhibitors MMP9, MMP2, MMP14 MMP9 1/4885MMP2 2/4885MMP1 9/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.