Iodide

Iodide

SCHEMBL2587637

CCCC[N+]1=C(C)C(C)(C)c2cc(C(=O)O)ccc21.[I-]

nearest known ligand 0.48

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 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
PLA2G4B P0C869 1/20 0.36
RARB P10826 4/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
MPL P40238 1/20 0.35

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
SCHEMBL12160878 0.99 MEN1 (0.46) MEN1LMNAMAPTTHRBHTT
Iodide SCHEMBL1051835 0.95 MEN1 (0.46) MEN1LMNAMAPTTHRBHTT
Iodide SCHEMBL19817517 0.95 MEN1 (0.46) MEN1LMNAMAPTTHRBHTT
SCHEMBL22664031 0.95 MEN1 (0.45) MEN1LMNAMAPTTHRBHTT
Iodide SCHEMBL20975474 0.87 THRB (0.47) MEN1LMNAMAPTTHRBHTT
SCHEMBL29271029 0.85 THRB (0.44) MEN1LMNAMAPTTHRBHTT
SCHEMBL3868600 0.85 TDP1 (0.40) MEN1LMNAMAPTTHRBHTT
SCHEMBL19063420 0.85 MEN1 (0.40) MEN1LMNAMAPTTHRBHTT
SCHEMBL3867446 0.84 TDP1 (0.39) MEN1LMNAMAPTTHRBHTT
SCHEMBL136801 0.84 MAPT (0.39) MEN1LMNAMAPTTHRBHTT

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-8404842-B2 Organic and inorganic photosensitizer dyes NATIONAL CENTRAL UNIVERSITY (TW) 2013-03-26 US disclosed
CN-102286212-A Organic and inorganic photosensitive dyes 2011-12-21 CN disclosed
US-20110288300-A1 Organic and inorganic photosensitizer dyes NAIONAL CENTRAL UNIVERSITY (TW) 2011-11-24 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-20110288300-A1 Organic and inorganic photosensitizer dyes IK, TYR, CRY1 MEN1 2830/4885LMNA 3574/4885MAPT 803/4885

“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.