SCHEMBL6062041

SCHEMBL6062041

N#CCNC(=O)[C@@H](N)CS(=O)(=O)Cc1ccccc1OC(F)F

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CTSC P53634 1/20 0.41
CTSS P25774 13/20 0.40
CTSB P07858 7/20 0.40
CTSL P07711 3/20 0.40
CTSK P43235 5/20 0.39
KMT2A Q03164 1/20 0.36

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
SCHEMBL5418267 0.89 CTSS (0.43) CTSSCTSBCTSLCTSKKMT2A
SCHEMBL6629347 0.88 CTSS (0.40) CTSSCTSBCTSLCTSKKMT2A
SCHEMBL6651832 0.88 CTSS (0.40) CTSSCTSBCTSLCTSKKMT2A
SCHEMBL5421069 0.85 CTSS (0.42) CTSSCTSBCTSLCTSK
SCHEMBL6745241 0.85 CTSS (0.43) CTSSCTSBCTSLCTSK
SCHEMBL6745245 0.85 CTSS (0.43) CTSSCTSBCTSLCTSK
SCHEMBL6740829 0.84 CTSS (0.48) CTSSCTSBCTSLCTSK
SCHEMBL6737501 0.83 CTSL (0.63) CTSSCTSBCTSLCTSK
SCHEMBL6737504 0.83 CTSL (0.63) CTSSCTSBCTSLCTSK
SCHEMBL6737929 0.82 CTSS (0.49) CTSSCTSBCTSLCTSK

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
EP-1694357-A1 USE OF CATHEPSIN S INHIBITORS FOR TREATING AN IMMUNE RESPONSE CAUSED BY ADMINISTRATION OF A SMALL MOLECULE THERAPEUTIC OR BIOLOGIC AXYS PHARMACEUTICALS, INC. (US) 2006-08-30 EP disclosed
WO-2005058348-A1 USE OF CATHEPSIN S INHIBITORS FOR TREATING AN IMMUNE RESPONSE CAUSED BY ADMINISTRATION OF A SMALL MOLECULE THERAPEUTIC OR BIOLOGIC AXYS PHARMACEUTICALS, INC. (US) 2005-06-30 WO disclosed
US-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors AXYS PHARMACEUTICALS, INC. 2004-01-22 US disclosed
US-6492362-B1 Compounds and compositions as cathepsin S inhibitors AXYS PHARMACEUTICALS, INC. 2002-12-10 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-20040014796-A1 Novel compounds and compositions as cathepsin S inhititors CTSS, CTSB, CTSE CTSC 13/4885CTSS 1/4885CTSB 2/4885

“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.