SCHEMBL8225467

SCHEMBL8225467

CCc1csc(N[C@H](C(=O)N2C[C@]3(C[C@H]2C(=O)NC(CC2CCC2)C(=O)C(N)=O)CC3(C)C)C(C)(C)C)n1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSV O60911 1/20 0.45
▸ CTSL P07711 1/20 0.45
▸ CTSB P07858 1/20 0.45
▸ ELANE P08246 1/20 0.45
▸ CMA1 P23946 1/20 0.45
▸ CTSS P25774 1/20 0.45
▸ CTSK P43235 1/20 0.45
▸ CTSF Q9UBX1 1/20 0.45
▸ PDF Q9HBH1 1/20 0.35
▸ F2 P00734 1/20 0.33
▸ NR1I2 O75469 3/20 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
SCHEMBL11938018 0.92 CTSV (0.43) CTSVCTSLCTSBELANECMA1
SCHEMBL13559977 0.92 CTSV (0.43) CTSVCTSLCTSBELANECMA1
SCHEMBL8220129 0.91 CTSV (0.44) CTSVCTSLCTSBELANECMA1
SCHEMBL11930156 0.91 CTSV (0.44) CTSVCTSLCTSBELANECMA1
SCHEMBL11936782 0.89 CTSK (0.41) CTSVCTSLCTSBELANECMA1
SCHEMBL8219312 0.89 CTSK (0.41) CTSVCTSLCTSBELANECMA1
SCHEMBL11930157 0.88 CTSK (0.42) CTSVCTSLCTSBELANECMA1
SCHEMBL8227722 0.88 CTSK (0.42) CTSVCTSLCTSBELANECMA1
SCHEMBL8228348 0.86 CTSB (0.40) CTSVCTSLCTSBELANECMA1
SCHEMBL11936553 0.86 CTSB (0.40) 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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 — — US disclosed
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 — — US disclosed
US-8445527-B2 Organic compounds and their uses NOVARTIS AG (CH) 2013-05-21 — — US disclosed
US-20120231998-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2012-09-13 — — US disclosed
US-8211932-B2 Organic compounds and their uses NOVARTIS AG (CH) 2012-07-03 — — US disclosed
US-8211932-B2 Organic compounds and their uses NOVARTIS AG (CH) 2012-07-03 — — US disclosed
US-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-30 — — US disclosed
US-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2010-12-30 — — US disclosed
US-7825152-B2 serine protease inhibitors, for the treatment of hepatitis c virus infections NOVARTIS AG (CH) 2010-11-02 — — US disclosed
US-7825152-B2 serine protease inhibitors, for the treatment of hepatitis c virus infections NOVARTIS AG (CH) 2010-11-02 — — US disclosed
US-20070286842-A1 Organic Compounds and Their Uses NOVARTIS AG (CH) 2007-12-13 — — US disclosed
US-20070286842-A1 Organic Compounds and Their Uses NOVARTIS AG (CH) 2007-12-13 — — US disclosed
WO-2007133865-A2 HCV/HIV INHIBITORS AN THEIR USES NOVARTIS AG (CH) 2007-11-22 — — 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 (4 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-20100331243-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 CTSV 2440/4885CTSL 2124/4885CTSB 1766/4885
US-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, HAVCR2, CPT1A CTSV 1362/4885CTSL 1337/4885CTSB 874/4885
US-20070286842-A1 Organic Compounds and Their Uses OAT, OTC, AOX1 CTSV 2440/4885CTSL 2124/4885CTSB 1766/4885
US-20120231998-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, OTC, AOX1 CTSV 2440/4885CTSL 2124/4885CTSB 1766/4885

“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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