SCHEMBL9103897

SCHEMBL9103897

CC(C)(C)N(C(=O)O)[C@H](C=O)CC1CCC1

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.33
CTSL P07711 2/20 0.30
CTSB P07858 2/20 0.30
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30
ATM Q13315 1/20 0.30
CTSS P25774 1/20 0.30
CTSH P09668 1/20 0.30

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
SCHEMBL1867665 0.95 CTSK (0.38) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL6245315 0.95 CTSK (0.38) CTSKCTSLCTSBSLC1A3SLC1A2
SCHEMBL9102349 0.94 ANPEP (0.33) CTSKCTSS
SCHEMBL15332671 0.87
SCHEMBL14975129 0.74 MEN1 (0.31)
SCHEMBL1642682 0.74 MEN1 (0.31)
SCHEMBL1864711 0.73 CTSK (0.36) CTSKCTSLCTSBATMCTSS
SCHEMBL4127198 0.73 RNPEP (0.33)
SCHEMBL10656233 0.73 CTSK (0.34) CTSKCTSLCTSBCTSSCTSH
SCHEMBL1862554 0.72 CTSK (0.39) CTSKCTSLCTSBATMCTSS

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-20120142668-A1 CATHEPSIN C INHIBITORS GLAXO GROUP LIMITED (GB) 2012-06-07 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-20120142668-A1 CATHEPSIN C INHIBITORS CTSE, CTSB, CTSS CTSK 8/4885CTSL 13/4885CTSB 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.