SCHEMBL30684686

SCHEMBL30684686

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)Oc1ccc([N+](=O)[O-])cc1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.58
TGM2 P21980 2/20 0.53
PPARG P37231 1/20 0.52
PPARA Q07869 1/20 0.52
ALDH1A1 P00352 2/20 0.48
TSHR P16473 1/20 0.48
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CA1 P00915 3/20 0.42
CA2 P00918 3/20 0.42
FAAH O00519 2/20 0.41
SIRT1 Q96EB6 1/20 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
SCHEMBL2109929 0.89 MGLL (0.54) MGLLTGM2PPARGPPARAALDH1A1
P-Nitrophenol SCHEMBL31174807 0.89 TGM2 (0.56) MGLLTGM2PPARGPPARAALDH1A1
SCHEMBL13041077 0.89 MGLL (0.54) MGLLTGM2PPARGPPARAALDH1A1
SCHEMBL29400674 0.89 MGLL (0.54) MGLLTGM2PPARGPPARAALDH1A1
SCHEMBL13752460 0.87 MGLL (0.55) MGLLTGM2PPARGPPARACA1
SCHEMBL14299860 0.87 MGLL (0.49) MGLLTGM2PPARGPPARAALDH1A1
SCHEMBL10077062 0.86 TGM2 (0.69) TGM2PPARGPPARAITGB3ITGA2B
SCHEMBL31519043 0.86 MGLL (0.54) MGLLTGM2PPARGPPARAALDH1A1
SCHEMBL23332178 0.85 TGM2 (0.50) TGM2ALDH1A1TSHRITGB3ITGA2B
SCHEMBL15625932 0.85 PPARG (0.52) MGLLTGM2PPARGPPARAALDH1A1

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
US-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PEPTIDREAM INC (JP) 2026-01-15 US disclosed
EP-4534524-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF PeptiDream Inc. (JP) 2025-04-09 EP disclosed
WO-2023234425-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF ペプチドリーム株式会社 2023-12-07 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-20260015313-A1 AMINO ACID ACTIVE ESTER AND SALT THEREOF NSUN3, BCAT1, SLC43A1 MGLL 3981/4885TGM2 3299/4885PPARG 3131/4885

“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.