SCHEMBL6740163

SCHEMBL6740163

CN(C#N)C(=O)[C@H](CS(=O)(=O)Cc1ccccc1OC(F)F)NC(=O)N1CCOCC1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSS P25774 19/20 0.42
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL1557679 0.86 CTSS (0.50) CTSSCTSLCTSB
SCHEMBL1987948 0.86 CTSS (0.50) CTSSCTSLCTSB
SCHEMBL5436195 0.85 CTSS (0.46) CTSSCTSLCTSBKMT2A
SCHEMBL6743322 0.85 CTSS (0.46) CTSSCTSLCTSBKMT2A
SCHEMBL7544951 0.85 CTSS (0.38) CTSSCTSLCTSB
SCHEMBL7547881 0.84 CTSB (0.41) CTSSCTSLCTSBKMT2A
SCHEMBL6062766 0.83 CTSS (0.39) CTSSCTSLCTSB
SCHEMBL6063311 0.82 CTSS (0.49) CTSSCTSLCTSB
SCHEMBL6063309 0.82 CTSS (0.49) CTSSCTSLCTSB
SCHEMBL7658551 0.82 CTSL (0.52) CTSSCTSLCTSBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors AXYS PHARMACEUTICALS, INC. 2004-01-22 US claimed

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-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors CTSS, CTSB, CTSE CTSS 1/4885CTSL 10/4885CTSB 2/4885

“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.