SCHEMBL16329059

SCHEMBL16329059

CC(C)(C)OC(=O)NC(C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)NC(CC1CC1)C(=O)C(N)=O)C2(C)C)C1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTSV O60911 1/20 0.60
▸ CTSL P07711 1/20 0.60
▸ CTSB P07858 1/20 0.60
▸ ELANE P08246 1/20 0.60
▸ CMA1 P23946 1/20 0.60
▸ CTSS P25774 1/20 0.60
▸ CTSK P43235 1/20 0.60
▸ CTSF Q9UBX1 1/20 0.60
▸ F13A1 P00488 1/20 0.40
▸ TGM2 P21980 1/20 0.40

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
SCHEMBL10140255 1.00 CTSV (0.60) CTSVCTSLCTSBELANECMA1
SCHEMBL16349191 0.99 CTSV (0.61) CTSVCTSLCTSBELANECMA1
SCHEMBL10140302 0.99 CTSV (0.61) CTSVCTSLCTSBELANECMA1
SCHEMBL10140639 0.98 CTSS (0.62) CTSVCTSLCTSBELANECMA1
SCHEMBL13689653 0.98 CTSS (0.62) CTSVCTSLCTSBELANECMA1
SCHEMBL10140520 0.98 CTSS (0.62) CTSVCTSLCTSBELANECMA1
SCHEMBL13689676 0.98 CTSS (0.62) CTSVCTSLCTSBELANECMA1
SCHEMBL13688788 0.98 CTSS (0.64) CTSVCTSLCTSBELANECMA1
SCHEMBL8355281 0.98 CTSS (0.64) CTSVCTSLCTSBELANECMA1
SCHEMBL10226899 0.98 CTSS (0.64) CTSVCTSLCTSBELANECMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2011-05-19 — — 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-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS HPN, TMPRSS15, VIP CTSV 64/4885CTSL 77/4885CTSB 124/4885

“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.

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