SCHEMBL16280310

SCHEMBL16280310

COc1ccc(C(=O)CCC(=O)NC(Cc2cccc(OC(F)(F)F)c2)B(O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 8/20 0.48
MMP1 P03956 1/20 0.44
TP53 P04637 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
GRIN2B Q13224 1/20 0.42
MAPK14 Q16539 1/20 0.42
PPARG P37231 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MME P08473 1/20 0.42
PSMB8 P28062 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
SCHEMBL15075926 1.00 PSMB5 (0.48) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL19034204 0.91 NPC1 (0.42) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL15058715 0.89 PSMB5 (0.57) PSMB5MMP1TP53GRIN2BPSMB8
SCHEMBL15058718 0.89 PSMB5 (0.57) PSMB5MMP1TP53GRIN2BPSMB8
SCHEMBL15075897 0.88 PSMB5 (0.48) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL15075889 0.87 PSMB5 (0.52) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL3658382 0.84 PSMB5 (0.51) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL13061957 0.83 PSMB5 (0.49) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL16280177 0.81 PSMB5 (0.52) PSMB5MMP1TP53RXFP1SMN1; SMN2
SCHEMBL15075861 0.81 PSMB5 (0.52) PSMB5MMP1TP53RXFP1SMN1; SMN2

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 3 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-20140364396-A1 Alpha-amino boronic acid derivatives, selective immunoproteasome inhibitors ARES TRADING SA (CH) 2014-12-11 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 (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 5/4885MMP1 2452/4885TP53 1038/4885

“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.