SCHEMBL5870477

SCHEMBL5870477

CC1OCC(=O)C1NC(=O)C(CC(=O)C1COCCN1)CC1CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.32
CTSS P25774 6/20 0.32
NAAA Q02083 1/20 0.30

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
SCHEMBL5870291 0.78 CTSS (0.53) CTSS
SCHEMBL14347626 0.73 NAAA (0.40) CTSSNAAA
Hydrochloric Acid SCHEMBL5627174 0.72 NAAA (0.39) CTSSNAAA
Hydrochloric Acid SCHEMBL5627163 0.72 NAAA (0.39) CTSSNAAA
SCHEMBL5870402 0.68 CTSS (0.42) CTSS
SCHEMBL14347630 0.66 CTSS (0.55) CTSSNAAA
SCHEMBL5870430 0.65 CTSS (0.42) CTSSNAAA
SCHEMBL5870500 0.64 CTSS (0.34) CTSSNAAA
SCHEMBL294162 0.63 CTSC (0.35)
SCHEMBL7034077 0.63 AAK1 (0.37) NAAA

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-7132449-B2 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LIMITED (GB) 2006-11-07 US disclosed
US-20040127424-A1 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPUTICS LIMITED (GB) 2004-07-01 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-20040127424-A1 Inhibitors of cruzipain and other cysteine proteases CPN1, CTRL, CPA1 LTA4H 1316/4885CTSS 24/4885NAAA 1250/4885

“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.