Telaprevir

Telaprevir

SCHEMBL1709083

CCCC(NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C1CCCCC1)C(C)(C)C)C(=O)C(=O)NC1CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NS3NS4A

The experimentally established mechanism targets of Telaprevir. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSB P07858 13/20 1.00
CTSL P07711 8/20 1.00
CTSK P43235 6/20 1.00
CTSS P25774 3/20 1.00
ELANE P08246 2/20 1.00
CTSV O60911 1/20 1.00
PLG P00747 1/20 1.00
CMA1 P23946 1/20 1.00
CELA1 Q9UNI1 1/20 1.00
ABCG2 Q9UNQ0 1/20 0.90
CRBN Q96SW2 1/20 0.59

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
Telaprevir SCHEMBL184177 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL19187546 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13201921 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13219678 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13219647 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13201959 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13201901 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL13219193 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL22171584 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE
Telaprevir SCHEMBL22171583 1.00 CTSB (1.00) CTSBCTSLCTSKCTSSELANE

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023074780-A1 THERAPEUTIC AGENT COMPOSITION 国立大学法人愛媛大学 2023-05-04 WO disclosed
US-20210052621-A1 METHODS FOR TREATING FLAVIVIRUSES AND ZIKA INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA, A CALIFORNIA CORPORATION (US) 2021-02-25 US disclosed
WO-2018136559-A1 METHODS FOR TREATING FLAVIVIRUSES AND ZIKA INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-07-26 WO disclosed
US-9605018-B2 Substituted nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2017-03-28 US disclosed
US-20170002037-A1 CYCLIC NUCLEOTIDE ANALOGS ALIOS BIOPHARMA, INC. 2017-01-05 US disclosed
CN-103554224-B A kind of preparation method of VX-960 深圳翰宇药业股份有限公司 2016-08-10 CN disclosed
CN-105646329-A Method for preparing telaprevir intermediate 重庆圣华曦药业股份有限公司 2016-06-08 CN disclosed
US-9278990-B2 Substituted nucleotide analogs ALIOS BIOPHARMA, INC. (US) 2016-03-08 US disclosed
US-20160039871-A1 NOVEL FORMS OF TELAPREVIR SANDOZ GMBH (AT) 2016-02-11 US disclosed
CN-103342736-B A kind of synthetic method of VX-960 SUZHOU UUGENE BIOPHARMA CO., LTD. (CN) 2016-02-10 CN disclosed
US-20100081672-A1 PH SENSITIVE MATRIX FORMULATION SCHERING CORPORATION 2010-04-01 US disclosed
US-20090191555-A1 HCV NS3-NS4 Protease Resistance Mutants VERTEX PHARMACEUTICALS (US) 2009-07-30 US disclosed
US-7494660-B2 HCV NS3-NS4A protease resistance mutants VERTEX PHARMACEUTICALS INCORPORATED (US) 2009-02-24 US disclosed
US-20080267915-A1 Hcv Ns3-Ns4a Protease Inhibition VERTEX PHARMACEUTICALS (US) 2008-10-30 US disclosed
US-20080267915-A1 Hcv Ns3-Ns4a Protease Inhibition VERTEX PHARMACEUTICALS (US) 2008-10-30 US disclosed
US-20070212683-A1 Co-crystals and pharmaceutical compositions comprising the same VERTEX PHARMACEUTICALS INCORPORATED 2007-09-13 US disclosed
US-20070207122-A1 COMPOSITONS AND METHODS OF USE OF RITONAVIR FOR TREATING HCV ABBOTT LABORATORIES 2007-09-06 US disclosed
US-20070207949-A1 Medicaments and methods combining a HCV protease inhibitor and an AKR competitor SCHERING CORPORATION 2007-09-06 US disclosed
US-20070207949-A1 Medicaments and methods combining a HCV protease inhibitor and an AKR competitor SCHERING CORPORATION 2007-09-06 US disclosed
US-20070105781-A1 Inhibitors of serine proteases VERTEX PHARMACEUTICALS INCORPORATED 2007-05-10 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 (8 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-20160039871-A1 NOVEL FORMS OF TELAPREVIR ACE, ACE2, CTSC CTSB 200/4885CTSL 30/4885CTSK 64/4885
US-20090191555-A1 HCV NS3-NS4 Protease Resistance Mutants ATG4A, CUL4A, TMPRSS4 CTSB 175/4885CTSL 229/4885CTSK 462/4885
US-20070105781-A1 Inhibitors of serine proteases PRSS1, SERPINB1, PRSS3 CTSB 48/4885CTSL 17/4885CTSK 72/4885
US-20070212683-A1 Co-crystals and pharmaceutical compositions comprising the same MLX, AGXT, CYP4X1 CTSB 4069/4885CTSL 1924/4885CTSK 2390/4885
US-20080267915-A1 Hcv Ns3-Ns4a Protease Inhibition SERPINB1, ERAP1, PREP CTSB 48/4885CTSL 59/4885CTSK 290/4885
US-20170002037-A1 CYCLIC NUCLEOTIDE ANALOGS NT5C2, NTPCR, PNP CTSB 3004/4885CTSL 2534/4885CTSK 3699/4885
US-20100081672-A1 PH SENSITIVE MATRIX FORMULATION SI, HRH2, TMPRSS15 CTSB 645/4885CTSL 722/4885CTSK 470/4885
US-20070207949-A1 Medicaments and methods combining a HCV protease inhibitor and an AKR competitor CTSV, AKR1B1, AKR1A1 CTSB 14/4885CTSL 12/4885CTSK 10/4885

“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.