SCHEMBL13624434

SCHEMBL13624434

CC[C@@H](CNc1ccc(N2CCC(C(=O)O)CC2)cc1)NC(=O)[C@H](CC(C)C)N[C@@H](c1ccc(OC)nc1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 14/20 0.41
CTSL P07711 14/20 0.41
CTSS P25774 7/20 0.41
CTSB P07858 6/20 0.41
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL13624315 0.93 CTSK (0.40) CTSKCTSLCTSSCTSBMAPT
SCHEMBL13624289 0.90 CTSK (0.48) CTSKCTSLCTSSCTSB
SCHEMBL13624431 0.87 CTSL (0.48) CTSKCTSLCTSSCTSB
SCHEMBL13624316 0.87 CTSK (0.39) CTSKCTSLCTSSCTSB
SCHEMBL13624310 0.85 CTSK (0.53) CTSKCTSLCTSSCTSB
SCHEMBL13624317 0.84 SMN1; SMN2 (0.42) CTSKCTSLCTSSCTSBLMNA
SCHEMBL13624391 0.83 CTSK (0.40) CTSKCTSLCTSSCTSB
SCHEMBL13624430 0.83 CTSK (0.40) CTSKCTSLCTSSCTSB
SCHEMBL13624312 0.82 CTSK (0.41) CTSKCTSLCTSSCTSB
SCHEMBL13624340 0.82 CTSS (0.45) CTSKCTSLCTSSCTSB

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 24/4885CTSS 5/4885

“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.