SCHEMBL5384933

SCHEMBL5384933

CC(C)C[C@H](N[C@@H](c1ccc(-c2ccc(C3(C(=O)O)CC3)cc2)cc1)C(F)(F)F)C(=O)NC1(C#N)CC1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.82
CTSK P43235 13/20 0.77
CTSB P07858 4/20 0.73
CTSS P25774 4/20 0.73
CTSV O60911 1/20 0.58
CTSF Q9UBX1 1/20 0.58

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
SCHEMBL2156165 0.91 CTSL (1.00) CTSLCTSKCTSBCTSSCTSV
SCHEMBL5373391 0.89 CTSK (0.85) CTSLCTSKCTSBCTSSCTSV
SCHEMBL5382409 0.89 CTSK (0.68) CTSLCTSKCTSBCTSSCTSV
SCHEMBL14337583 0.89 CTSK (0.73) CTSLCTSKCTSBCTSSCTSV
SCHEMBL3679022 0.88 CTSL (0.72) CTSLCTSKCTSBCTSS
SCHEMBL2157209 0.88 CTSK (0.87) CTSLCTSKCTSBCTSSCTSV
SCHEMBL5373982 0.87 CTSK (0.73) CTSLCTSKCTSBCTSS
SCHEMBL8294942 0.87 CTSL (0.61) CTSLCTSKCTSBCTSS
SCHEMBL8294127 0.87 CTSL (0.61) CTSLCTSKCTSBCTSS
SCHEMBL2155055 0.86 CTSL (0.84) CTSLCTSKCTSBCTSSCTSV

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1673336-B1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK CANADA INC (CA) 2014-06-04 EP claimed
US-7312353-B2 Cathespin cysteine protease inhibitors MERCK FROST CANADA & CO. (CA) 2007-12-25 US claimed
US-20060287373-A1 Cathepsin cysteine protease inhibitors MERCK CANADA INC. (CA) 2006-12-21 US claimed
EP-1673336-B1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK CANADA INC (CA) 2014-06-04 EP disclosed
EP-1673336-B1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK CANADA INC (CA) 2014-06-04 EP disclosed
US-7312353-B2 Cathespin cysteine protease inhibitors MERCK FROST CANADA & CO. (CA) 2007-12-25 US disclosed
US-7312353-B2 Cathespin cysteine protease inhibitors MERCK FROST CANADA & CO. (CA) 2007-12-25 US disclosed
US-7312353-B2 Cathespin cysteine protease inhibitors MERCK FROST CANADA & CO. (CA) 2007-12-25 US disclosed
US-20060287373-A1 Cathepsin cysteine protease inhibitors MERCK CANADA INC. (CA) 2006-12-21 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-20060287373-A1 Cathepsin cysteine protease inhibitors CTSE, CTSS, CTSB CTSL 9/4885CTSK 5/4885CTSB 3/4885

“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.