SCHEMBL13624190

SCHEMBL13624190

COc1ccc([C@H](N[C@@H](CC(C)C)C(=O)O)C(F)(F)F)c(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.54
SORT1 Q99523 1/20 0.54
CTSL P07711 8/20 0.51
CTSS P25774 6/20 0.51
CTSK P43235 6/20 0.51
CTSB P07858 4/20 0.51
ATM Q13315 1/20 0.44
TP53 P04637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
FOLH1 Q04609 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
SCHEMBL13624189 0.83 CTSL (0.69) GRNSORT1CTSLCTSSCTSK
SCHEMBL4827527 0.79 CTSL (0.78) CTSLCTSSCTSKCTSB
SCHEMBL23693794 0.75 CTSL (0.49) GRNSORT1CTSLCTSSCTSK
SCHEMBL23693671 0.75 CTSL (0.49) GRNSORT1CTSLCTSSCTSK
SCHEMBL29887000 0.75 CTSL (0.49) GRNSORT1CTSLCTSSCTSK
SCHEMBL13624199 0.74 GRN (0.58) GRNSORT1CTSLCTSSCTSK
SCHEMBL13624195 0.74 GRN (0.55) GRNSORT1CTSLCTSSCTSK
SCHEMBL14579994 0.73 CTSL (0.70) GRNSORT1CTSLCTSSCTSK
SCHEMBL13624187 0.73 CTSL (0.70) GRNSORT1CTSLCTSSCTSK
SCHEMBL2154979 0.73 CTSL (0.70) GRNSORT1CTSLCTSSCTSK

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 GRN 1362/4885SORT1 1642/4885CTSL 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.