SCHEMBL5556547

SCHEMBL5556547

COCCNC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSS P25774 12/20 0.71
CTSK P43235 10/20 0.71
CTSB P07858 4/20 0.71
CTSL P07711 2/20 0.71
AKT1 P31749 1/20 0.68
ACE P12821 1/20 0.56
CA2 P00918 1/20 0.55
PTPN1 P18031 1/20 0.53

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
SCHEMBL21010315 0.91 CTSS (0.79) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2440946 0.91 CTSS (0.79) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2446582 0.89 CTSS (0.76) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2442760 0.89 CTSS (0.76) CTSSCTSKCTSBCTSLAKT1
SCHEMBL5565889 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL6746907 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2447627 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2444606 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2405030 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1
SCHEMBL2442224 0.88 CTSS (0.74) CTSSCTSKCTSBCTSLAKT1

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 2 patents. 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
WO-2005027856-A2 INHIBITORS OF ANTHRAX LETHAL FACTOR CENGENT THERAPEUTICS (US) 2005-03-31 WO 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 CTSS 596/4885CTSK 306/4885CTSB 239/4885

“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.