SCHEMBL6708296

SCHEMBL6708296

Cc1cccc(C(=O)NCC2(C(=O)NCCN3CCc4cc(F)ccc43)CCCCC2)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSS P25774 13/20 0.61
CTSL P07711 8/20 0.61
CTSK P43235 4/20 0.61
LMNA P02545 2/20 0.46
THRB P10828 1/20 0.40
HSD17B10 Q99714 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39

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
SCHEMBL6686218 0.78 CTSS (0.64) CTSSCTSLCTSK
SCHEMBL6690844 0.77 CTSS (0.62) CTSSCTSLCTSKLMNATHRB
SCHEMBL4798799 0.77 CTSS (0.70) CTSSCTSLCTSK
SCHEMBL4798807 0.77 CTSS (0.70) CTSSCTSLCTSK
SCHEMBL6690317 0.77 CTSS (0.70) CTSSCTSLCTSKLMNAHSD17B10
SCHEMBL4799054 0.76 CTSS (0.76) CTSSCTSLCTSK
SCHEMBL4799060 0.76 CTSS (0.76) CTSSCTSLCTSK
SCHEMBL4797798 0.76 CTSL (1.00) CTSSCTSLCTSK
SCHEMBL4797808 0.76 CTSL (1.00) CTSSCTSLCTSK
SCHEMBL4803510 0.75 CTSS (0.85) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20040248887-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.