SCHEMBL6488429

SCHEMBL6488429

C[C@@H](NC(=O)C(=O)[C@H](CCCCNC(=O)N1CCOCC1)NC(=O)O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSK P43235 17/20 0.64
CTSL P07711 1/20 0.64
CTSS P25774 1/20 0.64
MEN1 O00255 1/20 0.45
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL6488436 1.00 CTSK (0.64) CTSKCTSLCTSSMEN1CNR1
SCHEMBL5637603 0.83 CTSS (0.48) CTSKCTSLCTSSMEN1CNR1
SCHEMBL6647329 0.83 CTSS (0.48) CTSKCTSLCTSSMEN1CNR1
SCHEMBL14260196 0.81 CTSK (0.87) CTSKCTSLCTSS
SCHEMBL4819313 0.79 CTSK (0.59) CTSKCTSLCTSS
SCHEMBL4819332 0.79 CTSK (0.59) CTSKCTSLCTSS
SCHEMBL14260215 0.79 CTSK (1.00) CTSKCTSLCTSS
SCHEMBL14260221 0.79 CTSK (1.00) CTSKCTSLCTSS
SCHEMBL14260209 0.79 CTSS (0.48) CTSKCTSLCTSSMEN1CNR1
Hydrochloric Acid SCHEMBL4907356 0.78 CTSS (0.48) CTSKCTSLCTSSMEN1CNR1

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-20050054819-A1 Cycloalkyl ketoamides derivatives useful as cathepsin k inhibitors SMITHKLINE BEECHAM CORPORATION 2005-03-10 US claimed

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-20050054819-A1 Cycloalkyl ketoamides derivatives useful as cathepsin k inhibitors CTSK, CTSS, CTSE CTSK 1/4885CTSL 12/4885CTSS 2/4885

“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.