SCHEMBL16468520

SCHEMBL16468520

[N-]=[N+]=NCCOCCOCCOCCN=C=S

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.47
MGMT P16455 1/20 0.36
MIF P14174 2/20 0.33
TRPA1 O75762 1/20 0.31

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
SCHEMBL29410061 0.84 NAAA (0.59) NAAAMIFTRPA1
SCHEMBL31373160 0.82 MGMT (0.43) MGMT
SCHEMBL31373165 0.82 MGMT (0.43) MGMT
SCHEMBL31373162 0.82 MGMT (0.43) MGMT
SCHEMBL31373088 0.82 MGMT (0.43) MGMT
SCHEMBL13434049 0.82 MGMT (0.43) MGMT
SCHEMBL14211649 0.82 MGMT (0.43) MGMT
SCHEMBL31758954 0.82 MGMT (0.43) MGMT
SCHEMBL13650682 0.82 MGMT (0.43) MGMT
SCHEMBL18858998 0.82 MGMT (0.43) MGMT

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-20250090643-A1 FUNCTIONALIZED BIOCATALYTICAL COMPOSITIONS PERSEO PHARMA AG (CH) 2025-03-20 US disclosed
EP-4466024-A1 FUNCTIONALIZED BIOCATALYTICAL COMPOSITIONS Perseo Pharma AG (CH) 2024-11-27 EP disclosed
CN-118574645-A Functionalized biocatalytic compositions 佩尔西奥制药公司 2024-08-30 CN disclosed
WO-2023139150-A1 FUNCTIONALIZED BIOCATALYTICAL COMPOSITIONS PERSEO PHARMA AG (CH) 2023-07-27 WO disclosed
EP-2788354-B1 FUNCTIONALISATION OF CAGE AMINE LIGANDS FOR METALLO-RADIOPHARMACEUTICALS UNIV MELBOURNE (AU) 2016-11-30 EP disclosed
US-9364570-B2 Functionalisation of cage amine ligands for metallo-radiopharmaceuticals THE UNIVERSITY OF MELBOURNE (AU) 2016-06-14 US disclosed
US-20150051392-A1 FUNCTIONALISATION OF CAGE AMINE LIGANDS FOR METALLO-RADIOPHARMACEUTICALS THE UNIVERSITY OF MELBOURNE (AU) 2015-02-19 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-20150051392-A1 FUNCTIONALISATION OF CAGE AMINE LIGANDS FOR METALLO-RADIOPHARMACEUTICALS SLC39A14, AOC1, RNF168 NAAA 2191/4885MGMT 10/4885MIF 314/4885

“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.