SCHEMBL13624413

SCHEMBL13624413

CC(C)C[C@H](N[C@@H](c1ccccc1)C(F)(F)F)C(=O)N[C@@H](CCCN)CNc1ccc(N2CCOCC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSL P07711 16/20 0.54
CTSK P43235 12/20 0.54
CTSB P07858 8/20 0.49
CTSS P25774 5/20 0.45
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL13624414 0.98 CTSL (0.54) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624416 0.95 CTSL (0.56) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624415 0.93 CTSL (0.55) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL4364254 0.93 CTSL (0.55) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624418 0.92 CTSL (0.57) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624372 0.90 CTSL (0.51) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624359 0.89 CTSL (0.54) CTSLCTSKCTSBCTSS
SCHEMBL13624361 0.88 CTSL (0.52) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624381 0.88 CTSL (0.56) CTSLCTSKCTSBCTSSL3MBTL1
SCHEMBL13624352 0.87 CTSL (0.62) CTSLCTSKCTSBCTSSL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 US disclosed
US-20090291945-A1 CYSTEINE PROTEASE INHIBITORS TEIJIN PHARMA LIMITED (JP) 2009-11-26 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-20090291945-A1 CYSTEINE PROTEASE INHIBITORS CTSE, SPINT2, CTSF CTSL 24/4885CTSK 15/4885CTSB 4/4885

“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.