SCHEMBL6700166

SCHEMBL6700166

N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCCN(S(=O)(=O)c2ccccn2)CC1=O

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 18/20 0.69
CTSL P07711 15/20 0.69
CTSS P25774 14/20 0.69
CTSB P07858 6/20 0.69
CTSV O60911 1/20 0.59

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
SCHEMBL4833031 1.00 CTSK (0.69) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5098780 0.91 CTSK (0.60) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5092521 0.90 CTSK (0.60) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4833257 0.90 CTSK (0.74) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5098859 0.90 CTSK (0.60) CTSKCTSLCTSSCTSBCTSV
SCHEMBL7596034 0.89 CTSK (0.58) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5093274 0.88 CTSK (0.59) CTSKCTSLCTSSCTSBCTSV
SCHEMBL5982923 0.88 CTSK (0.57) CTSKCTSLCTSSCTSBCTSV
SCHEMBL21067433 0.88 CTSK (0.68) CTSKCTSLCTSSCTSBCTSV
SCHEMBL4171722 0.88 CTSK (0.68) CTSKCTSLCTSSCTSBCTSV

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-20040192674-A1 Cathepsin L inhibitors SMITHKLINE BEECHAM CORPORATION 2004-09-30 US claimed
US-20040192674-A1 Cathepsin L inhibitors SMITHKLINE BEECHAM CORPORATION 2004-09-30 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-20040192674-A1 Cathepsin L inhibitors CTSE, CTSV, CTSL CTSK 9/4885CTSL 3/4885CTSS 5/4885

“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.