SCHEMBL4452889

SCHEMBL4452889

C=Cc1ccc(C(=O)NC(Cc2cccs2)C(=O)N2CCC3OCC(=O)C32)cc1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSK P43235 16/20 0.58
CTSS P25774 10/20 0.56
CTSL P07711 5/20 0.56
CTSV O60911 4/20 0.56

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
SCHEMBL6797981 0.89 CTSS (0.69) CTSKCTSSCTSLCTSV
SCHEMBL4449564 0.89 CTSK (0.59) CTSKCTSSCTSLCTSV
SCHEMBL4446428 0.88 CTSK (0.63) CTSKCTSSCTSLCTSV
SCHEMBL5256752 0.87 CTSK (0.62) CTSKCTSSCTSLCTSV
SCHEMBL5256435 0.87 CTSK (0.75) CTSKCTSSCTSLCTSV
SCHEMBL6798717 0.87 CTSK (0.57) CTSKCTSSCTSLCTSV
SCHEMBL4452648 0.87 CTSS (0.64) CTSKCTSSCTSLCTSV
SCHEMBL5259229 0.86 CTSK (0.59) CTSKCTSSCTSLCTSV
SCHEMBL6804272 0.86 CTSS (0.60) CTSKCTSSCTSLCTSV
SCHEMBL4452743 0.85 CTSK (0.57) CTSKCTSSCTSLCTSV

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-20090247471-A1 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LTD. (GB) 2009-10-01 US disclosed
US-7425562-B2 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LTD. (GB) 2008-09-16 US disclosed
EP-1362052-B1 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LTD (GB) 2007-03-07 EP disclosed
US-20040138250-A1 Inhibitors of cruzipain and other cysteine proteases GRUNENTHAL GMBH (DE) 2004-07-15 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-20040138250-A1 Inhibitors of cruzipain and other cysteine proteases CPN1, CTRL, CPA1 CTSK 62/4885CTSS 39/4885CTSL 23/4885
US-20090247471-A1 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES CPN1, CTRL, CPA1 CTSK 45/4885CTSS 21/4885CTSL 16/4885

“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.