SCHEMBL18677464

SCHEMBL18677464

O=C1Nc2ccccc2NS(=O)(=O)CS(=O)(=O)Nc2ccccc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 3/20 0.45
PDGFRA P16234 2/20 0.45
LTK P29376 2/20 0.45
DYRK1B Q9Y463 2/20 0.45
LRRK2 Q5S007 2/20 0.45
FER P16591 1/20 0.45
CDK8 P49336 1/20 0.45
CA12 O43570 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
CA7 P43166 2/20 0.41
CA9 Q16790 2/20 0.41
PDE7A Q13946 1/20 0.41
PDE7B Q9NP56 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PLCG1 P19174 1/20 0.39

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
SCHEMBL15672895 0.87 KMT2A (0.41) CA12CA1CA2CA4CA7
SCHEMBL5697347 0.78 ACVR1 (0.67) ACVR1PDGFRALTKDYRK1BLRRK2
SCHEMBL8590983 0.67 ACVR1 (0.44) ACVR1PDGFRALTKDYRK1BLRRK2
SCHEMBL16477920 0.65 MEN1 (0.34) CA12CA1CA2CA4CA7
SCHEMBL31501686 0.65 MEN1 (0.34) CA12CA1CA2CA4CA7
SCHEMBL2235632 0.65 PDE7A (0.62) ACVR1PDGFRALTKDYRK1BLRRK2
SCHEMBL11168286 0.64 ACVR1 (0.41) ACVR1PDGFRALTKDYRK1BLRRK2
SCHEMBL12242976 0.64 ACVR1 (0.56) ACVR1PDGFRALTKDYRK1BLRRK2
SCHEMBL3541086 0.64 MEN1 (0.33) CA12CA1CA2CA4CA7
SCHEMBL6309542 0.64 PDE7A (0.50) ACVR1PDGFRALTKDYRK1BLRRK2

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-11772085-B2 Far superior oxidation catalysts based on macrocyclic compounds CARNEGIE MELLON UNIVERSITY (US) 2023-10-03 US disclosed
US-11772085-B2 Far superior oxidation catalysts based on macrocyclic compounds CARNEGIE MELLON UNIVERSITY (US) 2023-10-03 US disclosed
EP-4015511-A1 OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS CARNEGIE MELLON UNIVERSITY (US) 2022-06-22 EP disclosed
EP-3353157-B1 OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS UNIV CARNEGIE MELLON (US) 2021-11-24 EP disclosed
US-20210086171-A1 FAR SUPERIOR OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS CARNEGIE MELLON UNIVERSITY 2021-03-25 US disclosed
US-10926248-B2 Far superior oxidation catalysts based on macrocyclic compounds CARNEGIE MELLON UNIVERSITY (US) 2021-02-23 US disclosed
WO-2017053564-A1 FAR SUPERIOR OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS CARNEGIE MELLON UNIVERSITY (US) 2017-03-30 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 (3 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-10926248-B2 Far superior oxidation catalysts based on macrocyclic compounds ME3, SOD1, DUOX1 ACVR1 4792/4885PDGFRA 4832/4885LTK 1878/4885
US-11772085-B2 Far superior oxidation catalysts based on macrocyclic compounds SOD1, ME3, ME2 ACVR1 4760/4885PDGFRA 4830/4885LTK 1975/4885
US-20210086171-A1 FAR SUPERIOR OXIDATION CATALYSTS BASED ON MACROCYCLIC COMPOUNDS ME3, ME2, ME1 ACVR1 4718/4885PDGFRA 4731/4885LTK 1898/4885

“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.