SCHEMBL5558595

SCHEMBL5558595

CC(C)C[C@H](CC(=O)NOCc1ccccc1)C(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)NCCC(N)=O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 13/20 0.59
MMP8 P22894 12/20 0.59
MMP2 P08253 10/20 0.59
MMP1 P03956 6/20 0.51
FCER2 P06734 2/20 0.49
MMP7 P09237 1/20 0.46
MMP12 P39900 1/20 0.46
MMP13 P45452 1/20 0.46

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
SCHEMBL5556742 0.84 MMP9 (0.58) MMP9MMP8MMP2MMP1FCER2
SCHEMBL5557641 0.79 MMP9 (0.45) MMP9MMP8MMP2MMP1FCER2
SCHEMBL3796377 0.77 MMP8 (0.79) MMP9MMP8MMP2MMP1MMP7
SCHEMBL6013881 0.77 MMP8 (0.79) MMP9MMP8MMP2MMP1MMP7
SCHEMBL7367696 0.76 MMP1 (0.69) MMP9MMP8MMP2MMP1FCER2
SCHEMBL5558431 0.75 MMP9 (0.80) MMP9MMP8MMP2MMP1FCER2
SCHEMBL5552720 0.75 MMP9 (0.80) MMP9MMP8MMP2MMP1FCER2
SCHEMBL7374482 0.74 MMP1 (0.72) MMP9MMP8MMP2MMP1FCER2
SCHEMBL5556805 0.74 MMP9 (0.79) MMP9MMP8MMP2MMP1FCER2
SCHEMBL7370265 0.74 MMP1 (0.57) MMP9MMP8MMP2MMP1FCER2

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-20070197577-A1 Inhibitors of anthrax lethal factor CENGENT THERAPEUTICS (US) 2007-08-23 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 (1 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-20070197577-A1 Inhibitors of anthrax lethal factor APAF1, ANTXR2, LITAF MMP9 182/4885MMP8 24/4885MMP2 85/4885

“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.