Iodide

Iodide

SCHEMBL15212150

CC[n+]1ccc(N2CCCC2)cc1.[I-]

nearest known ligand 0.59

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 3)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.58
CHKA P35790 14/20 0.59
BCHE P06276 1/20 0.58

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
SCHEMBL9328178 0.98 CHKA (0.61) CHKABCHEACHE
Water SCHEMBL15211988 0.96 CHKA (0.59) CHKABCHEACHE
Hydrochloric Acid SCHEMBL9328059 0.96 CHKA (0.59) CHKABCHEACHE
Bromide SCHEMBL9327138 0.96 CHKA (0.65) CHKABCHEACHE
SCHEMBL9329679 0.96 CHKA (0.62) CHKABCHEACHE
Bromide SCHEMBL9327388 0.94 CHKA (0.66) CHKABCHEACHE
Iodide SCHEMBL15212761 0.90 CHKA (0.61) CHKABCHEACHE
Iodide SCHEMBL15212212 0.86 CHKA (0.58) CHKABCHEACHE
SCHEMBL15212015 0.84 CHKA (0.59) CHKABCHEACHE
Iodide SCHEMBL15212172 0.83 CHKA (0.54) CHKABCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9890050-B2 Molecular sieve material, its synthesis and use EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-02-13 US disclosed
EP-2817262-B1 MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE EXXONMOBIL CHEMICAL PATENTS INC (US) 2017-11-15 EP disclosed
US-20160368778-A1 Molecular Sieve Material, Its Synthesis and Use EXXONMOBIL CHEMICAL PATENTS INC. 2016-12-22 US disclosed
US-9452423-B2 Molecular sieve material, its synthesis and use EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-09-27 US disclosed
US-20150025291-A1 Molecular Sieve Material, Its Synthesis and Use EXXONMOBIL CHEMICAL PATENTS INC. 2015-01-22 US disclosed
EP-2817262-A1 MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE ExxonMobil Chemical Patents Inc. (US) 2014-12-31 EP disclosed
WO-2013126140-A1 MOLECULAR SIEVE MATERIAL, ITS SYNTHESIS AND USE EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-08-29 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 (2 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-20150025291-A1 Molecular Sieve Material, Its Synthesis and Use RPS17, MMP17, MRPS27 ACHE 4404/4885CHKA 4726/4885BCHE 4848/4885
US-20160368778-A1 Molecular Sieve Material, Its Synthesis and Use MMP17, RPS17, CDK17 ACHE 4357/4885CHKA 4718/4885BCHE 4850/4885

“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.