SCHEMBL6696901

SCHEMBL6696901

CC(C)(C)c1ccc(C(=O)NC(Cc2ccc(F)cc2)C(=O)NC23CCCC2OCC3=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 9/20 0.42
CTSL P07711 7/20 0.39
CTSK P43235 5/20 0.39
CA2 P00918 1/20 0.38
CTSS P25774 3/20 0.37
CTSB P07858 3/20 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
SCHEMBL6300662 0.93 CTSL (0.39) CTSLCTSKCA2CTSSCTSB
SCHEMBL6300585 0.93 CTSL (0.39) CTSLCTSKCA2CTSSCTSB
SCHEMBL6698646 0.92 MEN1 (0.39) USP30CTSLCTSKCA2CTSS
SCHEMBL6300222 0.92 CTSL (0.39) USP30CTSLCTSKCA2CTSS
SCHEMBL6300636 0.90 CTSL (0.41) USP30CTSLCTSKCA2CTSS
SCHEMBL6294795 0.89 CTSB (0.49) USP30CTSLCTSKCA2CTSS
SCHEMBL6699255 0.89 CTSL (0.40) CTSLCTSKCTSSCTSB
SCHEMBL6992575 0.88 USP30 (0.48) USP30CTSLCTSKCA2CTSS
SCHEMBL6300527 0.87 CTSL (0.38) USP30CTSLCTSKCA2CTSS
SCHEMBL6294790 0.86 CTSL (0.39) CTSLCTSKCA2CTSSCTSB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106805-A1 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LIMITED (GB) 2004-06-03 US disclosed
EP-1358176-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-05 EP disclosed
WO-2002057246-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 WO 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-20040106805-A1 Inhibitors of cruzipain and other cysteine proteases CTRL, CPN1, CPA1 USP30 1218/4885CTSL 15/4885CTSK 46/4885

“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.