SCHEMBL7007005

SCHEMBL7007005

O=S(=O)(NCCCCCCNc1nsc2nccn12)c1cccc2ccccc12

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 10/20 0.75
TGM1 P22735 4/20 0.70
SCN1A P35498 2/20 0.52
SCN2A Q99250 2/20 0.52
SCN3A Q9NY46 2/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
HSD17B10 Q99714 1/20 0.52
NPY5R Q15761 4/20 0.50
AGTR1 P30556 1/20 0.50
AGTR2 P50052 1/20 0.50
HTR7 P34969 3/20 0.49
HTR6 P50406 2/20 0.49
HTR1A P08908 1/20 0.49
DRD2 P14416 1/20 0.49
HTR2A P28223 1/20 0.49

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
SCHEMBL7007199 0.90 F13A1 (0.62) F13A1TGM1SCN1ASCN2ASCN3A
SCHEMBL7006157 0.87 F13A1 (0.71) F13A1TGM1KDM4EALDH1A1HTR7
SCHEMBL7014440 0.87 F13A1 (0.80) F13A1TGM1KDM4EALDH1A1NPY5R
SCHEMBL7009881 0.86 F13A1 (0.69) F13A1TGM1HTR1A
SCHEMBL7006075 0.86 F13A1 (0.78) F13A1TGM1SCN1ASCN2ASCN3A
SCHEMBL7009337 0.86 F13A1 (0.78) F13A1TGM1SCN1ASCN2ASCN3A
SCHEMBL7008678 0.86 F13A1 (1.00) F13A1TGM1ALDH1A1NPY5R
SCHEMBL7010031 0.86 F13A1 (0.78) F13A1TGM1SCN1ASCN2ASCN3A
SCHEMBL7006348 0.85 F13A1 (0.74) F13A1TGM1SCN1ASCN2ASCN3A
SCHEMBL7003300 0.85 F13A1 (0.74) F13A1TGM1SCN1ASCN2ASCN3A

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 7/4885SCN1A 2284/4885

“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.