SCHEMBL6701575

SCHEMBL6701575

O=C(NC(Cc1ccc(Cl)c(Cl)c1)C(=O)NC12CCCC1OCC2=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.44
CTSL P07711 16/20 0.42
CYP2D6 P10635 3/20 0.40
KLKB1 P03952 2/20 0.40
CYP2C9 P11712 2/20 0.39
USP30 Q70CQ3 1/20 0.39

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
SCHEMBL6699086 0.92 KLKB1 (0.43) CTSLKLKB1USP30
SCHEMBL6294295 0.91 CTSL (0.40) CTSLCYP2D6CYP2C9
SCHEMBL6991868 0.90 CTSL (0.39) CTSLCYP2D6KLKB1CYP2C9
SCHEMBL6992575 0.90 USP30 (0.48) CTSLCYP2D6KLKB1CYP2C9USP30
SCHEMBL6294856 0.89 KLKB1 (0.43) TRPV1CTSLKLKB1USP30
SCHEMBL6295797 0.88 KLKB1 (0.43) TRPV1CTSLKLKB1USP30
SCHEMBL6699255 0.88 CTSL (0.40) CTSLCYP2D6KLKB1CYP2C9
SCHEMBL6702836 0.87 CTSL (0.41) CTSLCYP2D6KLKB1CYP2C9
SCHEMBL6695685 0.85 CTSB (0.45) CTSLCYP2D6KLKB1CYP2C9
SCHEMBL6703701 0.84 CTSL (0.44) CTSL

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 TRPV1 4430/4885CTSL 15/4885CYP2D6 4431/4885

“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.