SCHEMBL6476280

SCHEMBL6476280

CCC(C)(C)C[C@H](NC(=O)N1CCOCC1)C(=O)NC1C(=O)COC1CN1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 19/20 0.42
CTSK P43235 9/20 0.42
CTSL P07711 8/20 0.42
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL6484770 0.92 CTSS (0.47) CTSSCTSKCTSLPKMSMN1; SMN2
SCHEMBL6485792 0.91 CTSS (0.49) CTSSCTSKCTSL
SCHEMBL6475999 0.90 CTSS (0.40) CTSSCTSKCTSLPKMSMN1; SMN2
SCHEMBL6486477 0.88 CTSS (0.46) CTSSCTSKCTSL
SCHEMBL6477130 0.86 CTSS (0.49) CTSSCTSKCTSL
SCHEMBL6486052 0.86 CTSS (0.44) CTSSCTSKCTSL
SCHEMBL6476174 0.85 CTSS (0.41) CTSSCTSKCTSLPKMSMN1; SMN2
SCHEMBL6474920 0.85 CTSS (0.41) CTSSCTSKCTSL
SCHEMBL6486213 0.85 CTSS (0.45) CTSSCTSKCTSLPKMSMN1; SMN2
SCHEMBL6475532 0.84 CTSS (0.41) CTSSCTSKCTSLPKMSMN1; SMN2

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-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 US claimed
US-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 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-20050020588-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV CTSS 1/4885CTSK 4/4885CTSL 11/4885

“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.