SCHEMBL5870549

SCHEMBL5870549

CC1OCC(=O)C1NC(=O)C(CC1CCCCC1)SCc1ccsc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.37
CTSS P25774 3/20 0.37
CTSK P43235 1/20 0.37
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
PTBP1 P26599 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
CTSV O60911 2/20 0.32
CTSC P53634 1/20 0.31

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
SCHEMBL5870525 0.84 OPRK1 (0.33) CTSLCTSSCTSKSMN1; SMN2CTSV
SCHEMBL5870275 0.84 CTSC (0.43) CTSLCTSSCTSKSMN1; SMN2CTSV
SCHEMBL5870630 0.82 CTSL (0.37) CTSLCTSSCTSKALDH1A1MAPT
SCHEMBL5870575 0.82 CTSS (0.37) CTSLCTSSCTSKALDH1A1MAPT
SCHEMBL5870360 0.81 ALDH1A1 (0.40) CTSLCTSSCTSKALDH1A1MAPT
SCHEMBL5870371 0.80 C5AR1 (0.36) CTSLCTSSMAPTSMN1; SMN2CTSV
SCHEMBL14347626 0.72 NAAA (0.40) CTSLCTSSCTSVCTSC
Hydrochloric Acid SCHEMBL5627174 0.72 NAAA (0.39) CTSLCTSSCTSVCTSC
Hydrochloric Acid SCHEMBL5627163 0.72 NAAA (0.39) CTSLCTSSCTSVCTSC
SCHEMBL5870430 0.70 CTSS (0.42) CTSLCTSSCTSKCTSV

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 4 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
EP-1358174-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-05 EP disclosed
WO-2002057248-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-20040127424-A1 Inhibitors of cruzipain and other cysteine proteases CPN1, CTRL, CPA1 CTSL 22/4885CTSS 24/4885CTSK 58/4885

“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.