Cariporide

Cariporide

SCHEMBL936191

CC(C)c1ccc(C(=O)NC(=N)N)cc1S(C)(=O)=O.N=C(N)NC(=O)c1nc(Cl)c(N)nc1N

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SCNN1ASCNN1BSCNN1G

The experimentally established mechanism targets of Cariporide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCNN1A known ✓ P37088 12/20 0.43
ALDH1A1 P00352 6/20 0.48
HSD17B10 Q99714 4/20 0.48
KDM4E B2RXH2 4/20 0.48
HPGD P15428 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
CYP1A2 P05177 3/20 0.48
CYP2D6 P10635 3/20 0.48
THPO P40225 3/20 0.48
GMNN O75496 3/20 0.48
PMP22 Q01453 3/20 0.48
CYP3A4 P08684 2/20 0.48
NFKB1 P19838 2/20 0.48
HIF1A Q16665 2/20 0.48
LMNA P02545 2/20 0.48
STAT6 P42226 1/20 0.48
RECQL P46063 1/20 0.48
SLC9A1 P19634 2/20 0.46
SLC9A2 Q9UBY0 1/20 0.45
NPC1 O15118 2/20 0.43

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 SCHEMBL39639 0.84 SLC9A1 (0.61) SLC9A1SLC9A2
Cariporide SCHEMBL221094 0.83 SLC9A1 (0.63) SLC9A1SLC9A2
Cariporide SCHEMBL6261845 0.83 SLC9A1 (0.63) SLC9A1SLC9A2
Cariporide SCHEMBL220085 0.83 SLC9A1 (0.60) SLC9A1SLC9A2
Cariporide SCHEMBL1229789 0.83 SLC9A1 (0.60) SLC9A1SLC9A2
Amiloride SCHEMBL28404348 0.79 ALDH1A1 (0.60) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
Amiloride SCHEMBL29039882 0.76 SCNN1A (0.52) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
Amiloride SCHEMBL3253482 0.76 SCNN1A (0.57) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
Amiloride SCHEMBL28595428 0.75 ALDH1A1 (0.55) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2
Amiloride SCHEMBL15517241 0.75 SCNN1A (0.58) ALDH1A1HSD17B10KDM4EHPGDSMN1; SMN2

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
EP-2453897-A1 COMBINATION OF A SODIUM-PROTON EXCHANGER INHIBITOR AND OF A DIHYDRO-1,3,5-TRIAZINE AMINE DERIVATIVE Merck Patent GmbH (DE) 2012-05-23 EP disclosed
WO-2011006573-A1 COMBINATION OF A SODIUM-PROTON EXCHANGER INHIBITOR AND OF A DIHYDRO-1,3,5-TRIAZINE AMINE DERIVATIVE MERCK PATENT GMBH (DE) 2011-01-20 WO disclosed