SCHEMBL15058263

SCHEMBL15058263

COC(=O)CCC(=N)NO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.62
LMNA P02545 3/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 3/20 0.43
HSD17B10 Q99714 2/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 1/20 0.43
MEN1 O00255 2/20 0.41
CA12 O43570 1/20 0.40
CA14 Q9ULX7 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CYP1A2 P05177 2/20 0.40
ATM Q13315 1/20 0.40
HPGD P15428 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
RECQL P46063 1/20 0.35

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
SCHEMBL3050092 0.86 TSHR (0.58) TSHRLMNAKDM4EALDH1A1KMT2A
SCHEMBL3013718 0.80
Dimethyl Succinate SCHEMBL28054469 0.79 TSHR (1.00) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL10213 0.79 TSHR (1.00) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL29248752 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL27773027 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL16798755 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL28249858 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL7778900 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A
Dimethyl Succinate SCHEMBL31389405 0.76 TSHR (0.93) TSHRLMNAKDM4EALDH1A1KMT2A

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 5 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
EP-2793900-A1 ALPHA-AMINO BORONIC ACID DERIVATIVES, SELECTIVE IMMUNOPROTEASOME INHIBITORS Ares Trading S.A. (CH) 2014-10-29 EP 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 TSHR 4668/4885LMNA 2774/4885KDM4E 1318/4885

“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.