SCHEMBL3438902

SCHEMBL3438902

COCCCN(C)S(=O)(=O)N=[N+]=[N-]

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GSTO1 P78417 1/20 0.32
MAPK1 P28482 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
SCHEMBL3438882 0.80 MEN1 (0.34)
SCHEMBL3438906 0.71 MEN1 (0.46) MAPK1
SCHEMBL3438892 0.68
SCHEMBL23617444 0.67 GSTO1 (0.36) GSTO1MAPK1
SCHEMBL6543221 0.66
SCHEMBL22517371 0.61 ALDH1A1 (0.44) MAPK1
SCHEMBL1246071 0.61
SCHEMBL9913963 0.61 MAPK1 (0.45) MAPK1
SCHEMBL3438885 0.61
SCHEMBL9387067 0.60 PIK3CD (0.44) MAPK1

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
CN-114539106-B Synthetic method of stable isotope labeled taurinamide hydrochloride 梯尔希(南京)药物研发有限公司 2023-05-02 CN disclosed
US-20220186222-A1 LINKAGE MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2022-06-16 US disclosed
US-11155527-B2 Macromolecules comprising triazoles and related compounds MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-10-26 US disclosed
WO-2021030778-A1 LINKAGE MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2021-02-18 WO disclosed
US-20120101271-A1 DIAMINE SYNTHESIS VIA CATALYTIC C-H AMINATION OF AZIDES NATIONAL SCIENCE FOUNDATION 2012-04-26 US disclosed
US-20120101271-A1 DIAMINE SYNTHESIS VIA CATALYTIC C-H AMINATION OF AZIDES NATIONAL SCIENCE FOUNDATION 2012-04-26 US disclosed
EP-1756089-B1 MERCAPTOIMIDAZOLES AS CCR2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2008-10-22 EP 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-20120101271-A1 DIAMINE SYNTHESIS VIA CATALYTIC C-H AMINATION OF AZIDES DOHH, AOC1, ESD GSTO1 4152/4885MAPK1 3309/4885
US-11155527-B2 Macromolecules comprising triazoles and related compounds TUFM, PCNA, MRPS23 GSTO1 3460/4885MAPK1 4464/4885

“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.