SCHEMBL6630308

SCHEMBL6630308

N#CC(CCc1ccccc1)NC(=O)C(F)CCc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CTSC P53634 4/20 0.66
CTSS P25774 14/20 0.53
CTSB P07858 4/20 0.48
CTSL P07711 3/20 0.48
CTSF Q9UBX1 1/20 0.47

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
SCHEMBL6630078 1.00 CTSC (0.66) CTSCCTSSCTSBCTSLCTSF
SCHEMBL6062237 1.00 CTSC (0.66) CTSCCTSSCTSBCTSLCTSF
SCHEMBL6061898 0.84 CTSC (0.67) CTSCCTSSCTSBCTSL
SCHEMBL6063126 0.84 CTSC (0.67) CTSCCTSSCTSBCTSL
SCHEMBL6627501 0.84 CTSC (0.67) CTSCCTSSCTSBCTSL
SCHEMBL6063121 0.84 CTSC (0.67) CTSCCTSSCTSBCTSL
SCHEMBL7649115 0.83 CTSC (0.66) CTSCCTSSCTSBCTSL
SCHEMBL5464894 0.80 CTSC (1.00) CTSCCTSSCTSBCTSL
SCHEMBL6630849 0.80 CTSC (0.65) CTSCCTSSCTSBCTSLCTSF
SCHEMBL6630445 0.80 CTSC (0.65) CTSCCTSSCTSBCTSLCTSF

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040142999-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2004-07-22 US claimed
EP-1397340-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-03-17 EP claimed
WO-2002098850-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-12-12 WO claimed
US-20040142999-A1 Novel compounds and compositions as cathepsin inhibitors AVENTIS PHARMACEUTICALS INC. (US) 2004-07-22 US disclosed
EP-1397340-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-03-17 EP disclosed
WO-2002098850-A2 CHEMICAL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS AS CATHEPSIN S INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2002-12-12 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-20040142999-A1 Novel compounds and compositions as cathepsin inhibitors 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.