SCHEMBL7006472

SCHEMBL7006472

COc1cc(C)ccc1S(=O)(=O)NCCCCCCNc1nsc2nccn12

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F13A1 P00488 10/20 0.70
TGM1 P22735 4/20 0.59
NPY5R Q15761 1/20 0.47
POLB P06746 1/20 0.44
MEP1B Q16820 1/20 0.44
KMT2A Q03164 1/20 0.39
ALPL P05186 1/20 0.38
FABP4 P15090 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7007890 0.86 F13A1 (0.66) F13A1TGM1ALDH1A1
SCHEMBL7004379 0.85 F13A1 (0.64) F13A1TGM1NPY5RPOLB
SCHEMBL7006992 0.83 F13A1 (1.00) F13A1TGM1ALDH1A1
SCHEMBL7008014 0.82 F13A1 (0.62) F13A1TGM1NPY5RALDH1A1
SCHEMBL7004829 0.81 F13A1 (0.76) F13A1TGM1MEP1BKMT2A
SCHEMBL7008678 0.81 F13A1 (1.00) F13A1TGM1NPY5RALDH1A1
SCHEMBL7005720 0.80 F13A1 (0.80) F13A1TGM1KMT2AALDH1A1
SCHEMBL7003653 0.80 F13A1 (0.73) F13A1TGM1POLBKMT2AFABP4
SCHEMBL7004031 0.79 F13A1 (0.67) F13A1TGM1KMT2A
SCHEMBL7009658 0.79 F13A1 (0.67) F13A1TGM1NPY5RKMT2AALDH1A1

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 7/4885NPY5R 4498/4885

“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.