SCHEMBL6703701

SCHEMBL6703701

CC(C)CC(NC(=O)c1ccc(OC(F)(F)F)cc1)C(=O)NC12CCCC1OCC2=O

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 9/20 0.44
CTSK P43235 13/20 0.42
CTSS P25774 7/20 0.42
CTSB P07858 3/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
TAOK1 Q7L7X3 1/20 0.38
TAOK3 Q9H2K8 1/20 0.38

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
SCHEMBL6294857 0.90 CTSL (0.47) CTSLCTSKCTSSCTSB
SCHEMBL6699096 0.89 CTSL (0.45) CTSLCTSKCTSSCTSBTAS1R3
SCHEMBL6701483 0.87 CTSK (0.54) CTSLCTSKCTSSCTSBTAOK1
SCHEMBL6992575 0.87 USP30 (0.48) CTSLCTSKCTSSCTSB
SCHEMBL6294856 0.86 KLKB1 (0.43) CTSLCTSKCTSSCTSB
SCHEMBL6699225 0.86 CTSK (0.53) CTSLCTSKCTSSCTSBTAOK1
SCHEMBL6699086 0.85 KLKB1 (0.43) CTSLCTSKCTSSCTSB
SCHEMBL6698003 0.84 CTSL (0.45) CTSLCTSKCTSSCTSB
SCHEMBL6701575 0.84 TRPV1 (0.44) CTSL
SCHEMBL6295797 0.84 KLKB1 (0.43) CTSLCTSKCTSSCTSB

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 CTSL 15/4885CTSK 46/4885CTSS 19/4885

“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.