SCHEMBL4798097

SCHEMBL4798097

Cc1cccc(C(=O)N[C@@H](Cc2ccccc2Cl)C(=O)NCCN2CCc3cc(F)ccc32)c1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSS P25774 20/20 0.75
CTSL P07711 15/20 0.75
CTSK P43235 11/20 0.75
CTSB P07858 2/20 0.45
CTSV O60911 1/20 0.45

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
SCHEMBL4796307 0.89 CTSS (0.79) CTSSCTSLCTSKCTSBCTSV
SCHEMBL4796898 0.88 CTSS (0.76) CTSSCTSLCTSKCTSBCTSV
SCHEMBL4795483 0.88 CTSS (0.75) CTSSCTSLCTSKCTSBCTSV
SCHEMBL4797798 0.86 CTSL (1.00) CTSSCTSLCTSK
SCHEMBL4797808 0.86 CTSL (1.00) CTSSCTSLCTSK
SCHEMBL4796581 0.85 CTSS (0.80) CTSSCTSLCTSK
SCHEMBL4799086 0.83 CTSS (0.77) CTSSCTSLCTSK
SCHEMBL4799097 0.83 CTSS (0.77) CTSSCTSLCTSK
SCHEMBL6692874 0.83 CTSS (0.67) CTSSCTSLCTSK
SCHEMBL4799054 0.82 CTSS (0.76) CTSSCTSLCTSK

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-7384970-B2 Inhibitors of cathepsin S IRM LLC (BM) 2008-06-10 US claimed
US-20080242671-A1 INHIBITORS OF CATHEPSIN S IRM LLC (BM) 2008-10-02 US disclosed
US-7384970-B2 Inhibitors of cathepsin S IRM LLC (BM) 2008-06-10 US disclosed
US-20040248887-A1 Inhibitors of cathepsin S IRM LLC (BM) 2004-12-09 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-20040248887-A1 Inhibitors of cathepsin S CTSS, CTSB, CTSZ CTSS 1/4885CTSL 11/4885CTSK 9/4885
US-20080242671-A1 INHIBITORS OF CATHEPSIN S CTSS, CTSB, CTSZ CTSS 1/4885CTSL 11/4885CTSK 9/4885

“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.