SCHEMBL6833547

SCHEMBL6833547

CC(C)c1ccc(C(=O)N=C(N)NCS(=O)(=O)O)cc1S(C)(=O)=O

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 6/20 0.72
SLC9A2 Q9UBY0 1/20 0.68

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
Cariporide SCHEMBL611696 0.84 SLC9A1 (1.00) SLC9A1SLC9A2
Cariporide SCHEMBL31563713 0.81 SLC9A1 (1.00) SLC9A1SLC9A2
Cariporide SCHEMBL1648723 0.81 SLC9A1 (1.00) SLC9A1SLC9A2
SCHEMBL4355373 0.81 SLC9A1 (0.72) SLC9A1SLC9A2
Cariporide SCHEMBL8743795 0.80 SLC9A1 (0.97) SLC9A1SLC9A2
SCHEMBL7061450 0.78 SLC9A1 (0.71) SLC9A1SLC9A2
SCHEMBL18929891 0.74 SLC9A1 (0.71) SLC9A1SLC9A2
SCHEMBL8743809 0.72 SLC9A1 (0.76) SLC9A1SLC9A2
Hydrochloric Acid SCHEMBL8743818 0.71 SLC9A1 (0.74) SLC9A1SLC9A2
Cariporide SCHEMBL221094 0.71 SLC9A1 (0.63) SLC9A1SLC9A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040044081-A1 Diacyl-substituted guanidines, a process for their preparation, their use as medicament or diagnostic aid, and medicament containing them HOECHST AKTIENGESELLSCHAFT 2004-03-04 US disclosed
US-6632840-B1 Inhibiting the Na+/H+ exchanger, treating at least one of arrhythmias and shock HOECHST AKTIENGESELLSCHAFT (DE) 2003-10-14 US disclosed
US-6436999-B1 REACTING GUANIDINE AND CARBOCYCLIC ACIDS, TO FORM COMPOUNDS LIKE BIS(3-METHYLSULFONYL-4-I-PROPYLBENZOYL)GUANIDINE, USED FOR PROPHYLAXIS OF CARDIOVASCULAR DISORDERS AND AS PRODRUGS FOR SODIUM CHANNEL MODULATORS TO CONTROL BLOOD PRESSURE HOECHST AKTIENGESELLSCHAFT (DE) 2002-08-20 US 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-20040044081-A1 Diacyl-substituted guanidines, a process for their preparation, their use as medicament or diagnostic aid, and medicament containing them ADRA1B, ADRA1A, HYOU1 SLC9A1 37/4885SLC9A2 112/4885

“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.