SCHEMBL4990179

SCHEMBL4990179

CC(C)c1ccc(-c2ccccc2C2CCCCC2C(=O)NCC#N)cc1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 19/20 0.74
CTSB P07858 3/20 0.46
CTSL P07711 2/20 0.46
CTSS P25774 2/20 0.44

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
SCHEMBL4987639 0.89 CTSK (0.77) CTSKCTSBCTSLCTSS
SCHEMBL5688506 0.89 CTSK (0.77) CTSKCTSBCTSLCTSS
SCHEMBL4991669 0.89 CTSK (0.65) CTSKCTSBCTSLCTSS
SCHEMBL1379625 0.89 CTSK (0.65) CTSKCTSBCTSLCTSS
SCHEMBL4993036 0.88 CTSK (0.79) CTSKCTSBCTSLCTSS
SCHEMBL5688752 0.88 CTSK (0.79) CTSKCTSBCTSLCTSS
SCHEMBL4988348 0.88 CTSK (0.79) CTSKCTSBCTSLCTSS
SCHEMBL4987845 0.88 CTSK (0.79) CTSKCTSBCTSLCTSS
SCHEMBL4992040 0.88 CTSK (0.72) CTSKCTSBCTSLCTSS
SCHEMBL5686040 0.88 CTSK (0.72) CTSKCTSBCTSLCTSS

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
EP-1644326-B1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK CANADA INC (CA) 2016-11-02 EP claimed
US-7405229-B2 Cathepsin cysteine protease inhibitors MERCK FROSST CANADA & CO. (CA) 2008-07-29 US claimed
EP-1644326-B1 CATHEPSIN CYSTEINE PROTEASE INHIBITORS MERCK CANADA INC (CA) 2016-11-02 EP disclosed
US-7405229-B2 Cathepsin cysteine protease inhibitors MERCK FROSST CANADA & CO. (CA) 2008-07-29 US disclosed
US-20070167635-A1 Cathepsin cysteine protease inhibitors MERCK CANADA INC. (CA) 2007-07-19 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-20070167635-A1 Cathepsin cysteine protease inhibitors CTSB, CTSS, CTSK CTSK 3/4885CTSB 1/4885CTSL 10/4885

“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.