SCHEMBL6475541

SCHEMBL6475541

Cc1occc1C(=O)N[C@@H](CCC(C)C)C(=O)NC1C(=O)COC1CCN(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CTSL P07711 14/20 0.39
CTSS P25774 14/20 0.39
CTSK P43235 14/20 0.39
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL6485523 0.93 POLB (0.39) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6482906 0.89 CTSL (0.49) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6475754 0.89 POLB (0.40) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6476601 0.88 CTSL (0.53) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6476157 0.87 CTSL (0.45) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6475453 0.86 CTSL (0.47) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6586690 0.86 CTSL (0.34) CTSLCTSSCTSK
SCHEMBL6487260 0.85 POLB (0.45) POLBHSD17B10CTSLCTSSCTSK
SCHEMBL6475432 0.84 CTSL (0.44) CTSLCTSSCTSK
SCHEMBL6486953 0.84 CTSK (0.48) CTSLCTSSCTSK

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 POLB 3719/4885HSD17B10 1318/4885CTSL 11/4885

“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.