SCHEMBL6580334

SCHEMBL6580334

CC(C)C[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC1CN(CCNC(=O)c2ccc(F)cc2)CC1=O

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.50
CTSK P43235 14/20 0.49
CTSB P07858 1/20 0.47
CD274 Q9NZQ7 1/20 0.44
CTSS P25774 1/20 0.43

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
SCHEMBL6578151 0.88 CTSK (0.56) CTSLCTSKCTSBCTSS
SCHEMBL6580618 0.85 CTSK (0.54) CTSLCTSKCTSBCTSS
SCHEMBL6577961 0.85 CTSK (0.51) CTSLCTSKCTSBCTSS
SCHEMBL6578144 0.85 CTSK (0.55) CTSLCTSKCTSBCTSS
SCHEMBL6582647 0.84 CTSK (0.54) CTSLCTSKCTSBCTSS
SCHEMBL6580526 0.83 CTSK (0.51) CTSLCTSKCTSBCTSS
Lithium Ion SCHEMBL6579977 0.83 CTSK (0.52) CTSLCTSKCTSBCTSS
SCHEMBL6583598 0.82 CTSL (0.51) CTSLCTSKCD274CTSS
SCHEMBL6580581 0.80 CTSK (0.62) CTSLCTSKCTSBCTSS
SCHEMBL6580725 0.79 CTSK (0.47) CTSLCTSKCTSBCTSS

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040180927-A1 Inhibitors of cysteine protease SMITHKLINE BEECHAM CORPORATION 2004-09-16 US claimed
EP-0936912-B1 INHIBITORS OF CYSTEINE PROTEASE SMITHKLINE BEECHAM CORP (US) 2004-02-11 EP claimed
US-20020128476-A1 Inhibitors of cysteine protease SMITHKLINE BEECHAM CORPORATION 2002-09-12 US claimed
EP-0936912-B1 INHIBITORS OF CYSTEINE PROTEASE SMITHKLINE BEECHAM CORP (US) 2004-02-11 EP disclosed
US-20020128476-A1 Inhibitors of cysteine protease SMITHKLINE BEECHAM CORPORATION 2002-09-12 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 (2 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-20040180927-A1 Inhibitors of cysteine protease CTSK, CTSZ, CTSS CTSL 7/4885CTSK 1/4885CTSB 5/4885
US-20020128476-A1 Inhibitors of cysteine protease CTRC, RCE1, CTRL CTSL 8/4885CTSK 100/4885CTSB 60/4885

“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.