SCHEMBL6476585

SCHEMBL6476585

Cc1occc1C(=O)N[C@@H](CC(C)(C)Cc1ccccc1)C(=O)N[C@@H]1C(=O)CO[C@H]1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.43
TSHR P16473 1/20 0.43
CTSL P07711 7/20 0.41
CTSK P43235 7/20 0.41
CTSS P25774 6/20 0.41
CYP2C19 P33261 2/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
POLB P06746 3/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
PIN1 Q13526 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GFER P55789 1/20 0.37
GPR55 Q9Y2T6 1/20 0.36
ESR1 P03372 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL6484505 0.92 USP2 (0.46) USP2TSHRCTSLCTSKCTSS
SCHEMBL6475687 0.91 CTSL (0.51) USP2TSHRCTSLCTSKCTSS
SCHEMBL6486305 0.89 CTSL (0.45) USP2TSHRCTSLCTSKCTSS
SCHEMBL6483837 0.88 CTSL (0.42) USP2TSHRCTSLCTSKCTSS
SCHEMBL6484912 0.88 CTSL (0.52) USP2TSHRCTSLCTSKCTSS
SCHEMBL6476642 0.87 CTSK (0.49) CTSLCTSKCTSS
SCHEMBL6488445 0.86 CTSL (0.42) USP2TSHRCTSLCTSKCTSS
SCHEMBL6588469 0.86 CTSK (0.36) CTSLCTSKCTSS
SCHEMBL6483120 0.86 CTSL (0.42) USP2TSHRCTSLCTSKCTSS
SCHEMBL6484547 0.85 HPGD (0.44) USP2TSHRCTSLCTSKCTSS

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 USP2 240/4885TSHR 3069/4885CTSL 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.