SCHEMBL4345155

SCHEMBL4345155

CCN(CC)S(=O)(=O)c1ccc(C(=O)CBr)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.58
LMNA P02545 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
HPGD P15428 1/20 0.55
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
CA12 O43570 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
SLC22A6 Q4U2R8 1/20 0.51
SLC22A8 Q8TCC7 1/20 0.51
ABCC2 Q92887 1/20 0.51
SLC22A12 Q96S37 1/20 0.51
UGT1A7 Q9HAW7 1/20 0.51
SLC22A11 Q9NSA0 1/20 0.51
ALDH1A1 P00352 5/20 0.51
TSHR P16473 1/20 0.51
GSK3B P49841 2/20 0.50
TP53 P04637 1/20 0.50
CASP1 P29466 1/20 0.50

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
SCHEMBL13545215 0.86 HTT (0.61) HTTLMNASMN1; SMN2HPGDRAB9A
SCHEMBL6608580 0.83 GSK3B (0.53) HTTLMNASMN1; SMN2ALDH1A1GSK3B
SCHEMBL9962909 0.81 HTT (0.68) HTTLMNASMN1; SMN2HPGDRAB9A
Etebenecid SCHEMBL1643610 0.81 SMN1; SMN2 (0.75) HTTLMNASMN1; SMN2HPGDRAB9A
SCHEMBL11539324 0.81 HTT (0.55) HTTLMNASMN1; SMN2HPGDRAB9A
SCHEMBL4638414 0.79 HTT (0.61) HTTLMNASMN1; SMN2HPGDRAB9A
SCHEMBL2492611 0.79 HTT (0.61) HTTLMNASMN1; SMN2HPGDRAB9A
SCHEMBL3814018 0.78 TAS2R14 (0.73) MEN1KMT2A
SCHEMBL6406201 0.78 GSK3B (0.47) HTTLMNASMN1; SMN2ALDH1A1GSK3B
SCHEMBL125350 0.77 GSR (0.59) GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150338-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-05-09 US disclosed
CN-117355300-A Compounds and their use for the treatment of neurodegenerative, degenerative and metabolic diseases 佛罗里达大学研究基金会公司 2024-01-05 CN disclosed
EP-2046336-A2 3-ARYL-6-ARYL-7H-[1,2,4]TRIAZOLO[3,4-b][1,3,4]THIADIAZINES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF Cytovia, Inc. (US) 2009-04-15 EP disclosed
US-20080045514-A1 3-Aryl-6-aryl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2008-02-21 US disclosed
WO-2008011045-A2 3-ARYL-6-ARYL-7H-[1,2,4]TRIAZOLO[3,4-b][1,3,4]THIADIAZINES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2008-01-24 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 (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-20240150338-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS OAT, NLN, ABAT HTT 8/4885LMNA 378/4885SMN1; SMN2 30/4885
US-20080045514-A1 3-Aryl-6-aryl-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, CASP2 HTT 3128/4885LMNA 1056/4885SMN1; SMN2 3613/4885

“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.