SCHEMBL6492760

SCHEMBL6492760

CCCCC(C)(NC(=O)OC1(COc2ccnc(N3CCN(C)CC3)n2)CCC1)C(=O)C(=O)N[C@H](C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 18/20 0.61
CTSL P07711 2/20 0.39
CTSS P25774 2/20 0.39
ACHE P22303 1/20 0.36
ACACB O00763 1/20 0.36

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
SCHEMBL4910235 0.82 CTSK (0.66) CTSKCTSLCTSSACACB
SCHEMBL6492755 0.80 CTSK (0.66) CTSKCTSLCTSS
SCHEMBL4905765 0.78 CTSK (0.65) CTSKCTSLCTSSACACB
SCHEMBL4907528 0.77 CTSK (0.61) CTSKCTSLCTSSACHEACACB
SCHEMBL6646844 0.76 CTSK (0.65) CTSKCTSLCTSSACHEACACB
SCHEMBL4910175 0.76 CTSK (0.66) CTSKACACB
SCHEMBL14260267 0.76 CTSK (1.00) CTSKCTSLCTSS
SCHEMBL6646848 0.75 CTSK (0.63) CTSKCTSLCTSSACHEACACB
SCHEMBL6646902 0.75 CTSK (0.66) CTSKCTSLCTSS
SCHEMBL4910220 0.74 CTSK (0.73) CTSKCTSLCTSS

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 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-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.