Iodide

Iodide

SCHEMBL1428394

C[N+](C)(C)[C@@H](CCCCNC(=O)CCc1ccc(OCc2ccccc2)cc1)CNC(=O)c1nc(Cl)c(N)nc1N.[I-]

nearest known ligand 0.63

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNG

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.63
EPOR P19235 7/20 0.41
LTA4H P09960 1/20 0.41
EPHX2 P34913 1/20 0.41
SCNN1A P37088 4/20 0.41
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL11959314 0.99 KCNH2 (0.64) KCNH2EPORLTA4HEPHX2SCNN1A
Iodide SCHEMBL2290256 0.93 KCNH2 (0.74) KCNH2EPORSCNN1AKDM4E
SCHEMBL11959315 0.92 KCNH2 (0.75) KCNH2EPORSCNN1AKDM4E
SCHEMBL12379736 0.92 KCNH2 (0.75) KCNH2EPORSCNN1AKDM4E
SCHEMBL11980209 0.89 KCNH2 (0.62) KCNH2EPORLTA4HEPHX2SCNN1A
SCHEMBL2075136 0.89 KCNH2 (0.61) KCNH2EPORLTA4HEPHX2SCNN1A
Hydrochloric Acid SCHEMBL1134542 0.88 KCNH2 (0.60) KCNH2EPORLTA4HEPHX2SCNN1A
SCHEMBL11959364 0.85 KCNH2 (0.87) KCNH2LTA4HEPHX2SCNN1AKDM4E
SCHEMBL13573266 0.84 KCNH2 (0.85) KCNH2LTA4HEPHX2SCNN1AKDM4E
SCHEMBL1428391 0.84 KCNH2 (0.56) KCNH2EPORLTA4HEPHX2SCNN1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300010-B1 PYRAZINE DERIVATIVES AS EPITHELIAL SODIUM CHANNEL BLOCKERS NOVARTIS AG (CH) 2015-03-04 EP disclosed
US-8236808-B2 Pyrazine derivatives as ENAC blockers NOVARTIS AG (CH) 2012-08-07 US disclosed
US-20110201625-A1 Organic Comopunds NOVARTIS AG (CH) 2011-08-18 US disclosed
EP-2300010-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2011-03-30 EP disclosed
WO-2009150137-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 WO 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-20110201625-A1 Organic Comopunds OR10J3, CFTR, CLIC1 KCNH2 49/4885EPOR 1531/4885LTA4H 2039/4885

“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.