SCHEMBL13624337

SCHEMBL13624337

CC(C)C[C@H](N[C@@H](c1ccc(=O)[nH]c1)C(F)(F)F)C(=O)N[C@@H](C)CNc1ccc(N2CCOCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSS P25774 15/20 0.46
CTSK P43235 13/20 0.46
CTSL P07711 10/20 0.46
CTSB P07858 1/20 0.46
ALDH1A1 P00352 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL13624295 0.92 CTSL (0.48) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL13624335 0.87 CTSL (0.54) CTSSCTSKCTSLCTSBL3MBTL1
SCHEMBL13624339 0.85 CTSK (0.53) CTSSCTSKCTSLCTSB
SCHEMBL13624338 0.82 CTSL (0.46) CTSSCTSKCTSLCTSBL3MBTL1
SCHEMBL13624340 0.82 CTSS (0.45) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL4366149 0.79 CTSL (0.53) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL13624300 0.79 CTSL (0.51) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL13624298 0.78 CTSL (0.51) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL13624307 0.78 CTSK (0.48) CTSSCTSKCTSLCTSBALDH1A1
SCHEMBL13624418 0.77 CTSL (0.57) CTSSCTSKCTSLCTSBL3MBTL1

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 CTSS 5/4885CTSK 15/4885CTSL 24/4885

“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.