SCHEMBL7004923

SCHEMBL7004923

O=S(=O)(NCCCCCCNc1nsc2nccn12)c1cccc(F)c1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 8/20 0.77
TGM1 P22735 2/20 0.61
BRAF P15056 10/20 0.47
RAF1 P04049 6/20 0.45
ERN1 O75460 2/20 0.45
ABL1 P00519 2/20 0.45
FGFR1 P11362 2/20 0.45
FLT3 P36888 2/20 0.45
MAPK8 P45983 2/20 0.45
MAPK11 Q15759 2/20 0.45
MAPK14 Q16539 2/20 0.45
NTRK2 Q16620 2/20 0.45
HIPK1 Q86Z02 2/20 0.45
MAP3K20 Q9NYL2 2/20 0.45

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
SCHEMBL7005912 0.89 F13A1 (0.79) F13A1TGM1
SCHEMBL7008810 0.89 F13A1 (0.82) F13A1TGM1BRAFRAF1
SCHEMBL7004156 0.88 F13A1 (0.77) F13A1TGM1BRAFRAF1
SCHEMBL7003304 0.87 F13A1 (0.73) F13A1TGM1BRAFRAF1
SCHEMBL7007806 0.87 F13A1 (1.00) F13A1TGM1BRAF
SCHEMBL7004823 0.86 F13A1 (0.78) F13A1TGM1
SCHEMBL7005909 0.85 F13A1 (0.79) F13A1TGM1
SCHEMBL7009658 0.85 F13A1 (0.67) F13A1TGM1BRAF
SCHEMBL7005365 0.85 F13A1 (0.67) F13A1TGM1BRAF
SCHEMBL7004951 0.85 F13A1 (1.00) F13A1TGM1BRAF

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 7/4885BRAF 3474/4885

“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.