Iodide

Iodide

SCHEMBL3081990

C[N+](C)(Cc1ccc(NC(=O)c2cc3cc(Cl)ccc3[nH]2)cc1)C1CCCCC1.[I-]

nearest known ligand 0.61

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
PYGL P06737 10/20 0.61
NHERF1 O14745 3/20 0.61
CCR2 P41597 7/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55

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
SCHEMBL13148508 0.99 PYGL (0.62) PYGLNHERF1CCR2MEN1KMT2A
Hydrochloric Acid SCHEMBL2926379 0.98 PYGL (0.61) PYGLNHERF1CCR2MEN1KMT2A
Iodide SCHEMBL17555143 0.91 CCR2 (0.68) PYGLNHERF1CCR2MEN1KMT2A
SCHEMBL13148361 0.90 CCR2 (0.69) PYGLNHERF1CCR2MEN1KMT2A
Hydrochloric Acid SCHEMBL315416 0.89 CCR2 (0.68) PYGLNHERF1CCR2MEN1KMT2A
Iodide SCHEMBL17555151 0.81 PYGL (0.56) PYGLNHERF1CCR2MEN1KMT2A
Iodide SCHEMBL17555152 0.81 PYGL (0.56) PYGLNHERF1CCR2MEN1KMT2A
SCHEMBL13148505 0.80 PYGL (0.62) PYGLNHERF1MEN1KMT2ARXFP1
Iodide SCHEMBL17555127 0.80 CCR2 (0.59) CCR2RXFP1
Iodide SCHEMBL5241769 0.80 CCR2 (0.64) CCR2

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-1765803-B1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2016-03-09 EP disclosed
US-7799824-B2 Quaternary salt CCR2 antagonists ORAPHARMA, INC. (US) 2010-09-21 US disclosed
EP-1765803-A1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-28 EP disclosed
US-20060293379-A1 Quaternary salt CCR2 antagonists KENVUE BRANDS LLC 2006-12-28 US disclosed
WO-2006012135-A1 QUATERNARY SALT CCR2 ANTAGONISTS JANSSEN PHARMACEUTICA, N. V. (BE) 2006-02-02 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-20060293379-A1 Quaternary salt CCR2 antagonists CCR2, CCR1, CXCR2 PYGL 4506/4885NHERF1 467/4885CCR2 1/4885

“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.