SCHEMBL7003758

SCHEMBL7003758

CN(CCCCCCN(C)S(=O)(=O)c1ccccc1[N+](=O)[O-])c1nsc2nccn12

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 9/20 0.76
TGM1 P22735 4/20 0.76
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
VCAM1 P19320 2/20 0.39
MET P08581 1/20 0.35
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL7005235 0.86 F13A1 (1.00) F13A1TGM1MEN1KMT2A
SCHEMBL7009218 0.86 F13A1 (0.73) F13A1TGM1MEN1KMT2AVCAM1
SCHEMBL7004816 0.86 F13A1 (0.67) F13A1TGM1MEN1KMT2AMET
SCHEMBL7012245 0.85 F13A1 (0.98) F13A1TGM1MEN1KMT2A
SCHEMBL7012051 0.75 F13A1 (0.61) F13A1TGM1MEN1KMT2AMET
SCHEMBL7004147 0.74 F13A1 (1.00) F13A1TGM1MEN1KMT2A
SCHEMBL7004197 0.74 F13A1 (0.84) F13A1TGM1MEN1KMT2A
SCHEMBL1652853 0.74 KMT2A (0.61) F13A1TGM1MEN1KMT2AVCAM1
SCHEMBL7003647 0.74 F13A1 (1.00) F13A1TGM1MEN1KMT2A
SCHEMBL7010870 0.74 F13A1 (0.77) F13A1TGM1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030225007-A1 Sulfonamide derivatives of 3-substituted imidazol[1,2-d]-1,2,4-thiadiazoles and 3-substituted-[1,2,4] thiadiazolo[4,5-a] benzimidazole as inhibitors of fibrin cross-linking and transglutaminases APOTEX INC. 2003-12-04 US disclosed
EP-1348710-A1 Sulfonamide derivatives of 3-substituted imidazo[1,2-D]-1,2,4-thiadiazoles and 3-substituted-[1,2,4]thiadiazolo[4,5-A]benzimidazole as inhibitors of fibrin cross-linking and transglutaminases Apotex Inc. (CA) 2003-10-01 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 (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-20030225007-A1 Sulfonamide derivatives of 3-substituted imidazol[1,2-d]-1,2,4-thiadiazoles and 3-substituted-[1,2,4] thiadiazolo[4,5-a] benzimidazole as inhibitors of fibrin cross-linking and transglutaminases PIGS, FGB, SERPINE1 F13A1 14/4885TGM1 7/4885MEN1 3661/4885

“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.