SCHEMBL15075901

SCHEMBL15075901

O=C(CCC(=O)c1ccc2ccccc2c1)N[C@@H](Cc1ccsc1)B(O)O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 11/20 0.45
PSMB8 P28062 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HDAC1 Q13547 2/20 0.42
HDAC8 Q9BY41 1/20 0.42
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 1/20 0.42
OPRM1 P35372 2/20 0.41

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
SCHEMBL15058065 0.87 PSMB5 (0.50) PSMB5PSMB8ALDH1A1
SCHEMBL15075816 0.85 PSMB5 (0.46) PSMB5PSMB8SMN1; SMN2HPGDHDAC1
SCHEMBL15058494 0.84 PSMB5 (0.48) PSMB5PSMB8HDAC1HDAC8
SCHEMBL15075890 0.82 PSMB5 (0.53) PSMB5HDAC1HDAC8OPRM1
SCHEMBL15058365 0.81 PSMB5 (0.48) PSMB5PSMB8SMN1; SMN2KDM4EHPGD
SCHEMBL15075940 0.76 CAPN1 (0.52) PSMB5PSMB8HDAC1HDAC8NPC1
SCHEMBL20472894 0.76 CAPN1 (0.52) PSMB5PSMB8HDAC1HDAC8NPC1
SCHEMBL15058141 0.76 PSMB5 (0.45) PSMB5PSMB8
SCHEMBL19034188 0.75 SMN1; SMN2 (0.41) PSMB5PSMB8SMN1; SMN2HPGDHDAC1
SCHEMBL19034189 0.75 PSMB5 (0.39) PSMB5PSMB8HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PSMB5 5/4885PSMB8 10/4885SMN1; SMN2 3346/4885

“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.