SCHEMBL84978

SCHEMBL84978

CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)C1(C)CC1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 17/20 0.84
PSMB9 P28065 3/20 0.84
PSMB8 P28062 3/20 0.84
PSMB10 P40306 3/20 0.84
PSMB2 P49721 3/20 0.84
CYP3A4 P08684 2/20 0.84
CYP3A5 P20815 2/20 0.84
CYP3A7 P24462 2/20 0.84
CYP3A43 Q9HB55 2/20 0.84
PSMB11 A5LHX3 1/20 0.84
PSMD11 O00231 1/20 0.84
PSMD12 O00232 1/20 0.84
PSMD14 O00487 1/20 0.84
PSMA7 O14818 1/20 0.84
PSMD3 O43242 1/20 0.84
CTSB P07858 1/20 0.84
PSMC3 P17980 1/20 0.84
PSMB1 P20618 1/20 0.84
PSMA1 P25786 1/20 0.84
PSMA2 P25787 1/20 0.84

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
SCHEMBL23616222 1.00 PSMB5 (0.84) PSMB5PSMB9PSMB8PSMB10PSMB2
SCHEMBL9909637 0.93 PSMB5 (0.74) PSMB5PSMB9PSMB8PSMB10PSMB2
SCHEMBL8267515 0.93 PSMB5 (0.72) PSMB5PSMB9PSMB8PSMB10PSMB2
SCHEMBL84929 0.92 PSMB5 (0.73) PSMB5PSMB9PSMB8PSMB10PSMB2
SCHEMBL84985 0.91 PSMB5 (0.70) PSMB5PSMB9PSMB8PSMB10PSMB2
Carfilzomib SCHEMBL23616374 0.91 PSMB5 (1.00) PSMB5PSMB9PSMB8PSMB10PSMB2
Carfilzomib SCHEMBL20533771 0.91 PSMB5 (1.00) PSMB5PSMB9PSMB8PSMB10PSMB2
Carfilzomib SCHEMBL25438395 0.91 PSMB5 (1.00) PSMB5PSMB9PSMB8PSMB10PSMB2
Carfilzomib SCHEMBL21035706 0.91 PSMB5 (1.00) PSMB5PSMB9PSMB8PSMB10PSMB2
Carfilzomib SCHEMBL21036025 0.91 PSMB5 (1.00) PSMB5PSMB9PSMB8PSMB10PSMB2

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-20210228660-A1 USE OF PROTEASOME INHIBITOR AND ALPHAVIRUS IN PREPARATION OF ANTI-TUMOR MEDICAMENT GUANGZHOU VIROTECH PHARMACEUTICAL CO., LTD. (CN) 2021-07-29 US disclosed
WO-2017205392-A1 PEGYLATED CARFILZOMIB COMPOUNDS AMGEN INC. (US) 2017-11-30 WO disclosed
EP-3101026-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION Onyx Therapeutics, Inc. (US) 2016-12-07 EP disclosed
US-8367617-B2 Crystalline peptide epoxy ketone protease inhibitors and the synthesis of amino acid keto-epoxides ONYX THERAPEUTICS, INC. (US) 2013-02-05 US disclosed
US-8198270-B2 Compounds for proteasome enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2012-06-12 US disclosed
US-8129346-B2 Compounds for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2012-03-06 US disclosed
US-7737112-B2 Composition for enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2010-06-15 US disclosed
US-20090131421-A1 Compounds for proteasome enzyme inhibition ONYX THERAPEUTICS, INC. 2009-05-21 US disclosed
US-20090105156-A1 Crystalline peptide epoxy ketone protease inhibitors and the synthesis of amino acid keto-epoxides PROTEOLIX, INC. (US) 2009-04-23 US disclosed
US-7491704-B2 Peptide-based compounds include at least three peptide units, an epoxide or aziridine, and functionalization at the N-terminus inhibit specific activities of N-terminal nucleophile (Ntn) hydrolases, e.g., the chymotrypsin-like activity of the 20S proteasome; antiproliferative and antiinflammatory agents PROTEOLIX, INC. (US) 2009-02-17 US disclosed
US-20080200398-A1 Compounds For Enzyme Inhibition PROTEOLIX, INC. (US) 2008-08-21 US disclosed
US-20070191284-A1 Peptide-based compounds include at least three peptide units, an epoxide or aziridine, and functionalization at the N-terminus inhibit specific activities of N-terminal nucleophile (Ntn) hydrolases, e.g., the chymotrypsin-like activity of the 20S proteasome; antiproliferative and antiinflammatory agents PROTEOLIX, INC. (US) 2007-08-16 US disclosed
US-7232818-B2 Peptide-based compounds include at least three peptide units, an epoxide or aziridine, and functionalization at the N-terminus inhibit specific activities of N-terminal nucleophile (Ntn) hydrolases, e.g., the chymotrypsin-like activity of the 20S proteasome; antiproliferative and antiinflammatory agents PROTEOLIX, INC. (US) 2007-06-19 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 (5 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-20080200398-A1 Compounds For Enzyme Inhibition ANPEP, DNPEP, CPN1 PSMB5 24/4885PSMB9 8/4885PSMB8 46/4885
US-20090131421-A1 Compounds for proteasome enzyme inhibition PSMB1, PSMB9, PSMB3 PSMB5 14/4885PSMB9 2/4885PSMB8 27/4885
US-20210228660-A1 USE OF PROTEASOME INHIBITOR AND ALPHAVIRUS IN PREPARATION OF ANTI-TUMOR MEDICAMENT PSMB1, PSME1, PSMB2 PSMB5 28/4885PSMB9 36/4885PSMB8 11/4885
US-20070191284-A1 Peptide-based compounds include at least three peptide units, an epoxide or aziridine, and functionalization at the N-terminus inhibit specific activities of N-terminal nucleophile (Ntn) hydrolases, e.g., the chymotrypsin-like activity of the 20S proteasome; antiproliferative and antiinflammatory agents ANPEP, DNPEP, PSMB1 PSMB5 21/4885PSMB9 4/4885PSMB8 34/4885
US-20090105156-A1 Crystalline peptide epoxy ketone protease inhibitors and the synthesis of amino acid keto-epoxides PREP, ANPEP, DNPEP PSMB5 567/4885PSMB9 702/4885PSMB8 555/4885

“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.