Relacatib

Relacatib

SCHEMBL6841517

CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@@H]1CC[C@@H](C)N(S(=O)(=O)c2ccccn2)CC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 1.00
CTSL P07711 18/20 1.00
CTSS P25774 14/20 1.00
CTSB P07858 4/20 1.00
CTSV O60911 2/20 1.00

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
Relacatib SCHEMBL30218824 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL29394783 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL1587331 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL27107043 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL30218825 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL6215260 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL23856125 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
Relacatib SCHEMBL7258401 1.00 CTSK (1.00) CTSKCTSLCTSSCTSBCTSV
SCHEMBL6842090 0.92 CTSK (0.86) CTSKCTSLCTSSCTSBCTSV
SCHEMBL13784216 0.91 CTSK (0.84) CTSKCTSLCTSSCTSBCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7563784-B2 Protease inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-07-21 US disclosed
US-7563784-B2 Protease inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2009-07-21 US disclosed
US-20040044201-A1 Protease inhibitors GLAXOSMITHKLINE LLC 2004-03-04 US disclosed
WO-2003045909-A2 METHODS AND INTERMEDIATES FOR THE SYNTHESIS OF AZEPINES SMITHKLINE BEECHAM CORPORATION (US) 2003-06-05 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-20040044201-A1 Protease inhibitors CTSK, CTSE, CTSZ CTSK 1/4885CTSL 11/4885CTSS 5/4885

“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.