SCHEMBL6483305

SCHEMBL6483305

CCC1OCC(=O)C1NC(=O)[C@H](CC(C)(C)CCc1ccccc1)NC(=O)c1ccoc1C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 17/20 0.50
CTSS P25774 17/20 0.50
CTSK P43235 17/20 0.50
USP2 O75604 2/20 0.45
TSHR P16473 1/20 0.45
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
GFER P55789 1/20 0.39

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
SCHEMBL6475687 0.92 CTSL (0.51) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6484505 0.91 USP2 (0.46) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6484155 0.91 USP2 (0.41) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6486925 0.90 USP2 (0.41) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6489560 0.88 CTSL (0.56) CTSLCTSSCTSKPOLBHPGD
SCHEMBL7457786 0.87 CTSL (0.60) CTSLCTSSCTSK
SCHEMBL6487529 0.87 CTSL (0.60) CTSLCTSSCTSK
SCHEMBL6485077 0.87 CTSL (0.53) CTSLCTSSCTSK
SCHEMBL6589005 0.87 CTSK (0.44) CTSLCTSSCTSK
SCHEMBL6477777 0.86 CTSL (0.65) CTSLCTSSCTSKPOLBHPGD

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-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 US claimed
US-20050020588-A1 Cysteine protease inhibitors PEPTIMMUNE, INC. 2005-01-27 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-20050020588-A1 Cysteine protease inhibitors CTSS, CTSE, CTSV CTSL 11/4885CTSS 1/4885CTSK 4/4885

“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.