SCHEMBL13624291

SCHEMBL13624291

CC[C@@H](CNc1ccc(N2CCOCC2)cc1)NC(=O)[C@H](CC(C)C)N[C@@H](c1cccnc1)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.50
CTSK P43235 9/20 0.50
CNR2 P34972 1/20 0.44
CTSS P25774 6/20 0.42
CTSB P07858 2/20 0.42
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 2/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL13624338 0.92 CTSL (0.46) CTSLCTSKCNR2CTSSCTSB
SCHEMBL4366149 0.87 CTSL (0.53) CTSLCTSKCTSSCTSBSMN1; SMN2
SCHEMBL13624300 0.87 CTSL (0.51) CTSLCTSKCTSSCTSB
SCHEMBL13624296 0.86 CTSK (0.52) CTSLCTSKCNR2CTSSCTSB
SCHEMBL13624298 0.86 CTSL (0.51) CTSLCTSKCTSSCTSBSMN1; SMN2
SCHEMBL13624289 0.86 CTSK (0.48) CTSLCTSKCTSSCTSBPSEN1
SCHEMBL13624299 0.85 CTSL (0.49) CTSLCTSKCTSSCTSBMAPT
SCHEMBL13624290 0.84 CTSK (0.51) CTSLCTSKCTSSCTSB
SCHEMBL13624418 0.83 CTSL (0.57) CTSLCTSKCTSSCTSBL3MBTL1
SCHEMBL13624295 0.83 CTSL (0.48) CTSLCTSKCTSSCTSBSMN1; SMN2

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 15/4885CNR2 3065/4885

“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.