Iodide

Iodide

SCHEMBL2532622

Cn1cc[n+](CCCCCCCCCCCC[n+]2ccn(C)c2)c1.[I-].[I-]

nearest known ligand 0.41

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 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
Iodide SCHEMBL2531279 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2535592 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2526028 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2533637 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2530037 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2532275 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2529354 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
Iodide SCHEMBL2531357 1.00 KDM4E (0.38) KDM4ENPC1LMNAHTTRAB9A
SCHEMBL11999067 0.98 BCHE (0.39)
Iodide SCHEMBL2530880 0.98 KDM4E (0.34) KDM4ENPC1LMNAHTTRAB9A

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-8632914-B2 Triazolium and imidazolium salts and uses thereof UNIVERSITY HEALTH NETWORK (CA) 2014-01-21 US disclosed
US-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF UNIVERSITY HEALTH NETWORK (CA) 2011-10-20 US disclosed
WO-2010025558-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF AS ANTIMALARIALS UNIVERSITY HAEALTH NETWORK (CA) 2010-03-11 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-20110257235-A1 TRIAZOLIUM AND IMIDAZOLIUM SALTS AND USES THEREOF ARG2, ARG1, CIT KDM4E 3006/4885NPC1 3713/4885LMNA 2957/4885

“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.