SCHEMBL13624445

SCHEMBL13624445

CC[C@@H](CNc1ccc(N2CCC(C(=O)O)CC2)cc1)NC(=O)[C@H](CC(C)C)N[C@@H](Cc1ccccc1)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSK P43235 16/20 0.53
CTSL P07711 16/20 0.53
CTSB P07858 7/20 0.48
CTSS P25774 2/20 0.40
EPHX2 P34913 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
SCHEMBL13624301 0.90 CTSK (0.64) CTSKCTSLCTSBCTSS
SCHEMBL13624431 0.88 CTSL (0.48) CTSKCTSLCTSBCTSS
SCHEMBL13624313 0.82 CTSL (0.48) CTSKCTSLCTSBCTSS
SCHEMBL13624385 0.81 CTSL (0.48) CTSKCTSLCTSBCTSS
SCHEMBL13624437 0.80 CTSL (0.47) CTSKCTSLCTSBCTSS
SCHEMBL13624438 0.80 CTSL (0.47) CTSKCTSLCTSBCTSS
SCHEMBL13624435 0.80 CTSL (0.46) CTSKCTSLCTSBCTSS
SCHEMBL13624434 0.79 CTSK (0.41) CTSKCTSLCTSBCTSS
SCHEMBL13624314 0.76 CTSL (0.45) CTSKCTSLCTSBCTSS
SCHEMBL13624447 0.75 CTSL (0.47) CTSKCTSLCTSBCTSS

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 CTSK 15/4885CTSL 24/4885CTSB 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.