SCHEMBL8267541

SCHEMBL8267541

CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)COCCN1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)OC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRL P40313 7/20 0.58
TMPRSS11D O60235 5/20 0.58
PSMB5 P28074 11/20 0.57
CYP3A4 P08684 2/20 0.57
CYP3A5 P20815 2/20 0.57
CYP3A7 P24462 2/20 0.57
CYP3A43 Q9HB55 2/20 0.57
PSMB9 P28065 2/20 0.57
PSMB11 A5LHX3 1/20 0.57
PSMD11 O00231 1/20 0.57
PSMD12 O00232 1/20 0.57
PSMD14 O00487 1/20 0.57
PSMA7 O14818 1/20 0.57
PSMD3 O43242 1/20 0.57
CTSB P07858 1/20 0.57
PSMC3 P17980 1/20 0.57
PSMB1 P20618 1/20 0.57
PSMA1 P25786 1/20 0.57
PSMA2 P25787 1/20 0.57
PSMA3 P25788 1/20 0.57

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
SCHEMBL17750788 1.00 CTRL (0.58) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL16254118 0.90 CTRL (0.59) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL8266994 0.90 CTRL (0.71) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL20284864 0.90 CTRL (0.71) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL20000632 0.90 CTRL (0.71) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL8267559 0.90 CTRL (0.64) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL16104625 0.90 CTRL (0.64) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL21793849 0.85 CTRL (0.57) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL84994 0.85 PSMB5 (0.68) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5
SCHEMBL22545161 0.84 CTRL (0.56) CTRLTMPRSS11DPSMB5CYP3A4CYP3A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210179663-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PROTEOLIX, INC. 2021-06-17 US disclosed
US-20200325172-A1 Compounds for proteasome enzyme inhibition PROTEOLIX, INC. 2020-10-15 US disclosed
US-20190211058-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PROTEOLIX, INC. 2019-07-11 US disclosed
US-20180170962-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION ONYX THERAPEUTICS INC (US) 2018-06-21 US disclosed
US-20160222057-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION ONYX THERAPEUTICS INC (US) 2016-08-04 US disclosed
US-8198270-B2 Compounds for proteasome enzyme inhibition ONYX THERAPEUTICS, INC. (US) 2012-06-12 US disclosed
US-20090131421-A1 Compounds for proteasome enzyme inhibition ONYX THERAPEUTICS, INC. 2009-05-21 US disclosed
US-7417042-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) 2008-08-26 US disclosed
WO-2006017842-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PROTEOLIX, INC. (US) 2006-02-16 WO disclosed
US-20060030533-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) 2006-02-09 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 (7 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-20160222057-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20180170962-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20200325172-A1 Compounds for proteasome enzyme inhibition PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20190211058-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20090131421-A1 Compounds for proteasome enzyme inhibition PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20210179663-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PSMB1, PSMB9, PSMB3 CTRL 43/4885TMPRSS11D 338/4885PSMB5 14/4885
US-20060030533-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, CPN1 CTRL 10/4885TMPRSS11D 386/4885PSMB5 23/4885

“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.