SCHEMBL7442268

SCHEMBL7442268

CC(C)C[C@H](N)C(=O)N[C@H]1CCCCOCC1=O

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 0.46
CTSL P07711 2/20 0.46
CTSS P25774 2/20 0.46
MMP1 P03956 1/20 0.38
MMP3 P08254 1/20 0.38

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
SCHEMBL7523273 0.96 CTSK (0.47) CTSKCTSLCTSS
SCHEMBL7521949 0.77 CTSK (0.44) CTSKCTSLCTSS
SCHEMBL7453474 0.77 CTSK (0.44) CTSKCTSLCTSS
SCHEMBL7451209 0.76 CTSK (0.38) CTSKCTSLCTSS
SCHEMBL6405564 0.76 MMP1 (0.43) CTSKMMP1MMP3
SCHEMBL7449341 0.75 CTSK (0.34) CTSKCTSLCTSS
SCHEMBL7455803 0.74 CTSK (0.37) CTSKCTSLCTSSMMP1MMP3
SCHEMBL6236079 0.74 CTSK (0.42) CTSKCTSLCTSS
SCHEMBL7372465 0.73 MMP1 (0.66) MMP1MMP3
SCHEMBL5099276 0.72 CTSK (0.46) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020165222-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-11-07 US claimed
EP-1153022-A4 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2002-03-27 EP claimed
EP-1153022-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-14 EP claimed
WO-2000049011-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2000-08-24 WO claimed
US-20020165222-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-11-07 US disclosed
EP-1153022-A4 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2002-03-27 EP disclosed
EP-1153022-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2001-11-14 EP disclosed
WO-2000049011-A1 PROTHEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2000-08-24 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-20020165222-A1 Protease inhibitors CTSK, CTSZ, CTSE CTSK 1/4885CTSL 20/4885CTSS 8/4885

“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.