SCHEMBL6488445

SCHEMBL6488445

Cc1occc1C(=O)N[C@@H](CC(C)(C)Cc1ccccc1)C(=O)NC1C(=O)COC1CCN(C)C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 11/20 0.42
CTSS P25774 11/20 0.42
CTSK P43235 11/20 0.42
USP2 O75604 2/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
GAA P10253 2/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PIN1 Q13526 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GFER P55789 1/20 0.34

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
SCHEMBL6484155 0.93 USP2 (0.41) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6475687 0.91 CTSL (0.51) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6475453 0.90 CTSL (0.47) CTSLCTSSCTSKHPGDPOLB
SCHEMBL6482953 0.89 CTSL (0.43) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6476601 0.89 CTSL (0.53) CTSLCTSSCTSKHPGDPOLB
SCHEMBL6483197 0.88 CTSK (0.50) CTSLCTSSCTSK
SCHEMBL6592491 0.87 CTSK (0.38) CTSLCTSSCTSK
SCHEMBL6476157 0.87 CTSL (0.45) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6476585 0.86 USP2 (0.43) CTSLCTSSCTSKUSP2TSHR
SCHEMBL6475452 0.86 CTSL (0.47) 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 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.