SCHEMBL28969873

SCHEMBL28969873

CCC(C)C(NC(=O)OC(C)(C)C)C(=O)NCCO

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.69
CTSK P43235 3/20 0.69
CA2 P00918 3/20 0.58
PSENEN Q9NZ42 1/20 0.48
CAPN1 P07384 1/20 0.43
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 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
SCHEMBL26818255 0.87 CTSS (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL13921024 0.87 CTSS (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL13921008 0.87 CTSS (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL13934284 0.87 CTSK (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL13934344 0.87 CTSK (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL5559974 0.87 CTSK (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL28969869 0.87 CTSK (0.67) CTSSCTSKCA2PSENENCAPN1
SCHEMBL16909078 0.86 CTSS (0.70) CTSSCTSKCA2PSENENCAPN1
SCHEMBL16921308 0.86 CTSS (0.66) CTSSCTSKCA2PSENENCAPN1
SCHEMBL16921307 0.86 CTSS (0.70) CTSSCTSKCA2PSENENCAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12466784-B2 Analogs of pterostilbene amino acid bearing carbonates for treating a non-alcoholic fatty liver disease and nonalcoholic steatohepatitis APICAL MOLECULAR BIOTECH CO., LTD. (TW) 2025-11-11 US disclosed
EP-4136063-B1 NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS APICAL MOLECULAR BIOTECH CO LTD (TW) 2025-10-22 EP disclosed
US-20230234912-A1 NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS APICAL MOLECULAR BIOTECH CO., LTD. (TW) 2023-07-27 US disclosed
CN-115835860-A Novel analogues of pterostilbene amino acids with carbonate for the treatment of non-alcoholic fatty liver disease and non-alcoholic steatohepatitis 树顶分子生技股份有限公司 2023-03-21 CN 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 (2 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-20230234912-A1 NOVEL ANALOGS OF PTEROSTILBENE AMINO ACID BEARING CARBONATES FOR TREATING A NON-ALCOHOLIC FATTY LIVER DISEASE AND NONALCOHOLIC STEATOHEPATITIS FABP1, GLS2, SLC1A5 CTSS 1586/4885CTSK 2360/4885CA2 1312/4885
US-12466784-B2 Analogs of pterostilbene amino acid bearing carbonates for treating a non-alcoholic fatty liver disease and nonalcoholic steatohepatitis FABP1, GLS2, SLC1A5 CTSS 1661/4885CTSK 2286/4885CA2 1131/4885

“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.