SCHEMBL15075940

SCHEMBL15075940

COc1ccccc1C(=O)CCC(=O)N[C@@H](Cc1ccsc1)B(O)O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 5/20 0.52
CTNNB1 P35222 2/20 0.48
WNT3A P56704 2/20 0.48
PSMB5 P28074 8/20 0.44
TDP1 Q9NUW8 1/20 0.44
HDAC8 Q9BY41 1/20 0.43
HDAC1 Q13547 1/20 0.43
NPC1 O15118 1/20 0.42
PSMB8 P28062 3/20 0.42

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
SCHEMBL20472894 1.00 CAPN1 (0.52) CAPN1CTNNB1WNT3APSMB5TDP1
SCHEMBL15075900 0.87 CAPN1 (0.53) CAPN1PSMB5NPC1PSMB8
SCHEMBL15075814 0.82 CAPN1 (0.57) CAPN1CTNNB1WNT3APSMB5HDAC8
SCHEMBL15076012 0.82 CAPN1 (0.57) CAPN1CTNNB1WNT3APSMB5HDAC8
SCHEMBL15058065 0.82 PSMB5 (0.50) PSMB5PSMB8
SCHEMBL15075890 0.81 PSMB5 (0.53) PSMB5HDAC8HDAC1
SCHEMBL15075816 0.78 PSMB5 (0.46) PSMB5HDAC1PSMB8
SCHEMBL15075901 0.76 PSMB5 (0.45) PSMB5HDAC8HDAC1NPC1PSMB8
SCHEMBL15058494 0.76 PSMB5 (0.48) PSMB5HDAC8HDAC1PSMB8
SCHEMBL15058141 0.73 PSMB5 (0.45) PSMB5PSMB8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2793900-B1 ALPHA-AMINO BORONIC ACID DERIVATIVES, SELECTIVE IMMUNOPROTEASOME INHIBITORS ARES TRADING SA (CH) 2018-08-22 EP disclosed
US-9688702-B2 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING (CH) 2017-06-27 US disclosed
US-9688702-B2 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING (CH) 2017-06-27 US disclosed
US-9688702-B2 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING (CH) 2017-06-27 US disclosed
US-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING SA (CH) 2014-12-11 US disclosed
US-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING SA (CH) 2014-12-11 US disclosed
US-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING SA (CH) 2014-12-11 US disclosed
WO-2013092979-A1 ALPHA-AMINO BORONIC ACID DERIVATIVES, SELECTIVE IMMUNOPROTEASOME INHIBITORS ARES TRADING S.A. (CH) 2013-06-27 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 (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-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors PSMB7, PSMA7, PSMB1 CAPN1 671/4885CTNNB1 2463/4885WNT3A 4502/4885

“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.