SCHEMBL13624371

SCHEMBL13624371

CC[C@@H](CNc1ccc2c(c1)OCO2)NC(=O)[C@H](CC(C)C)N[C@@H](c1ccc(OC)cc1)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.51
CTSL P07711 3/20 0.48
CTSS P25774 2/20 0.48
CTSB P07858 1/20 0.48
MAPT P10636 4/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
GFER P55789 1/20 0.40
FPR1 P21462 1/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL13624370 0.90 CTSL (0.49) CTSKCTSLCTSSCTSBMAPT
SCHEMBL13624293 0.82 CTSL (0.48) CTSKCTSLCTSSCTSBMAPT
SCHEMBL13624358 0.80 CTSL (0.52) CTSKCTSLCTSSCTSBTAS1R3
SCHEMBL13624362 0.80 CTSK (0.57) CTSKCTSLCTSSCTSB
SCHEMBL4369729 0.76 CTSL (0.48) CTSKCTSLCTSSCTSBTAS1R3
SCHEMBL13624351 0.75 CTSK (0.54) CTSKCTSLCTSSCTSB
SCHEMBL13624309 0.75 CTSL (0.58) CTSKCTSLCTSSCTSB
SCHEMBL13624330 0.75 CTSL (0.56) CTSKCTSLCTSSCTSBKMT2A
SCHEMBL13624364 0.74 CTSK (0.53) CTSKCTSLCTSS
SCHEMBL13624297 0.74 CTSK (0.50) 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.