SCHEMBL5558802

SCHEMBL5558802

CNC(=O)[C@@H](Cc1ccc2ccccc2c1)NC(=O)[C@@H](CC(=O)O)CC(C)C

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.81
MMP9 P14780 12/20 0.81
MMP8 P22894 12/20 0.81
MMP1 P03956 9/20 0.70
MMP3 P08254 4/20 0.70
MMP7 P09237 3/20 0.63
FCER2 P06734 2/20 0.63
MMP13 P45452 1/20 0.56

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
SCHEMBL5556655 1.00 MMP2 (0.81) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5558806 1.00 MMP2 (0.81) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5556662 1.00 MMP2 (0.81) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5552919 0.89 MMP2 (1.00) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5552911 0.89 MMP2 (1.00) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5556836 0.89 MMP2 (1.00) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5558390 0.89 MMP8 (0.84) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5558393 0.89 MMP8 (0.84) MMP2MMP9MMP8MMP1MMP3
SCHEMBL6434826 0.88 MMP2 (0.73) MMP2MMP9MMP8MMP1MMP3
SCHEMBL5099222 0.87 MMP2 (0.80) MMP2MMP9MMP8MMP1MMP3

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 MMP2 85/4885MMP9 182/4885MMP8 24/4885

“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.