SCHEMBL5558587

SCHEMBL5558587

CC(C)C[C@H](CC(=O)NOCc1ccccc1)C(=O)N[C@@H](C)c1ccc2ccccc2c1C(=O)NC(C)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.49
MMP9 P14780 9/20 0.49
MMP8 P22894 8/20 0.49
MMP1 P03956 6/20 0.44
FCER2 P06734 3/20 0.44
ERAP2 Q6P179 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
LNPEP Q9UIQ6 1/20 0.41
ECE1 P42892 1/20 0.40
MMP7 P09237 3/20 0.39
MMP12 P39900 2/20 0.39
MMP13 P45452 2/20 0.39
MMP3 P08254 2/20 0.38
BIRC2 Q13490 1/20 0.38
METAP2 P50579 1/20 0.37
METAP1 P53582 1/20 0.37

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
SCHEMBL5556734 0.90 MMP2 (0.46) MMP2MMP9MMP8MMP1FCER2
SCHEMBL7370265 0.83 MMP1 (0.57) MMP2MMP9MMP8MMP1FCER2
SCHEMBL5552656 0.77 MMP9 (0.64) MMP2MMP9MMP8MMP1FCER2
SCHEMBL5558591 0.73 MMP2 (0.43) MMP2MMP9MMP8MMP1FCER2
SCHEMBL7374482 0.72 MMP1 (0.72) MMP2MMP9MMP8MMP1FCER2
SCHEMBL7367696 0.72 MMP1 (0.69) MMP2MMP9MMP8MMP1FCER2
SCHEMBL5556742 0.72 MMP9 (0.58) MMP2MMP9MMP8MMP1FCER2
SCHEMBL7370874 0.72 MMP2 (0.53) MMP2MMP9MMP8MMP1FCER2
SCHEMBL5558595 0.71 MMP9 (0.59) MMP2MMP9MMP8MMP1FCER2
SCHEMBL7370260 0.70 MMP2 (0.53) MMP2MMP9MMP8MMP1FCER2

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.