SCHEMBL7004816

SCHEMBL7004816

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

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 8/20 0.67
TGM1 P22735 4/20 0.67
MET P08581 2/20 0.37
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NR1D1 P20393 1/20 0.33
SLC10A6 Q3KNW5 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
SCHEMBL7012051 0.89 F13A1 (0.61) F13A1TGM1METMEN1KMT2A
SCHEMBL7009684 0.87 F13A1 (0.65) F13A1TGM1METNR1D1
SCHEMBL7003758 0.86 F13A1 (0.76) F13A1TGM1METMEN1KMT2A
SCHEMBL7005235 0.80 F13A1 (1.00) F13A1TGM1MEN1KMT2A
SCHEMBL7012245 0.79 F13A1 (0.98) F13A1TGM1MEN1KMT2A
SCHEMBL29940773 0.78 MEN1 (0.43) METMEN1KMT2A
SCHEMBL7010870 0.73 F13A1 (0.77) F13A1TGM1MEN1KMT2A
SCHEMBL7009218 0.73 F13A1 (0.73) F13A1TGM1METMEN1KMT2A
SCHEMBL22023023 0.73 EPHX2 (0.39) MEN1KMT2A
SCHEMBL30368678 0.73 EPHX2 (0.39) MEN1KMT2A

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 7/4885MET 3968/4885

“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.