Iodide

Iodide

SCHEMBL1735888

CCCn1cc[n+](C(F)(F)C(F)F)c1.[I-]

nearest known ligand 0.36

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 14)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.35
MEN1 O00255 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
PLA2G1B P04054 1/20 0.33
HSP90AA1 P07900 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33

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
SCHEMBL5078826 0.98 FDPS (0.35) FDPSMEN1APAF1NPC1PLA2G1B
SCHEMBL5510335 0.85 FDPS (0.34) FDPS
SCHEMBL421255 0.84 FDPS (0.33) FDPS
SCHEMBL372633 0.80 FDPS (0.38) FDPSMEN1APAF1NPC1PLA2G1B
SCHEMBL426135 0.75 FDPS (0.31) FDPS
SCHEMBL3767086 0.74 MEN1 (0.39) FDPSMEN1APAF1NPC1PLA2G1B
SCHEMBL427413 0.74
SCHEMBL5074260 0.74
Bromide SCHEMBL2679421 0.73
SCHEMBL424477 0.71 FDPS (0.31) FDPS

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8715521-B2 Absorption cycle utilizing ionic liquid as working fluid E I DU PONT DE NEMOURS AND COMPANY (US) 2014-05-06 US disclosed
US-8707720-B2 Hybrid vapor compression-absorption cycle E I DU PONT DE NEMOURS AND COMPANY (US) 2014-04-29 US disclosed
US-8628644-B2 Utilizing ionic liquids for hydrofluorocarbon separation E I DU PONT NEMOURS AND COMPANY (US) 2014-01-14 US disclosed
US-8568608-B2 Vapor compression cycle utilizing ionic liquid as compressor lubricant E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-29 US disclosed
EP-1954680-B1 IONIC LIQUIDS DU PONT (US) 2012-05-23 EP disclosed
EP-1846535-B1 ABSORPTION CYCLE UTILIZING IONIC LIQUID AS WORKING FLUID DU PONT (US) 2011-11-16 EP disclosed
EP-2368960-A1 Vapor compression utilizing ionic liquid as compressor lubricant E. I. du Pont de Nemours and Company (US) 2011-09-28 EP disclosed
EP-2258787-A2 Absorption cycle utilizing ionic liquid as working fluid E. I. du Pont de Nemours and Company (US) 2010-12-08 EP disclosed
US-7838679-B2 Pyridinium cation and fluoroalkylsulfonate or fluoroalkylsulfonimide anions; solvents and catalysts E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-23 US disclosed
US-7838684-B2 Fluorinated anions; cation selected from pyridinium, pyridazinium, pyrimidinium, pyrazinium, imidazolium, pyrazolium, thiazolium, oxazolium, triazolium, and phosphonium, ammonium cations with specified substituents, and anion is fluorinated sulfonium, sulfonylimide E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-11-23 US disclosed
US-20070100181-A1 Olefin isomerization E. I. DU PONT DE NEMOURS AND COMPANY 2007-05-03 US disclosed
US-20070100184-A1 Alkylation of aromatic compounds E. I. DU PONT DE NEMOURS AND COMPANY 2007-05-03 US disclosed
WO-2007050492-A1 ALKYLATION OF AROMATIC COMPOUNDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-05-03 WO disclosed
WO-2007038360-A2 PREPARATION OF POLYTRIMETHYLENE ETHER GLYCOL AND COPOLYMERS THEREOF E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-04-05 WO disclosed
WO-2007038359-A1 IONIC LIQUIDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-04-05 WO disclosed
US-20070066852-A1 Preparation of poly(tetramethylene) glycol THE CHEMOURS COMPANY FC, LLC 2007-03-22 US disclosed
US-20070066854-A1 Preparation of polytrimethylene ether glycol and copolymers thereof THE CHEMOURS COMPANY FC, LLC 2007-03-22 US disclosed
US-20070066822-A1 Ionic liquids THE CHEMOURS COMPANY FC, LLC 2007-03-22 US disclosed
US-20070019708-A1 Hybrid vapor compression-absorption cycle E. I. DU PONT DE NEMOURS AND COMPANY 2007-01-25 US disclosed
US-20060197053-A1 Absorption cycle utilizing ionic liquid as working fluid E. I. DU PONT DE NEMOURS AND COMPANY 2006-09-07 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 (5 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-20070100184-A1 Alkylation of aromatic compounds TYR, ALK, AHR FDPS 793/4885MEN1 1923/4885APAF1 329/4885
US-20070066854-A1 Preparation of polytrimethylene ether glycol and copolymers thereof PARG, PTGES3, PGD FDPS 1220/4885MEN1 1773/4885APAF1 1602/4885
US-20070100181-A1 Olefin isomerization OSBP, OXER1, ALOX12 FDPS 853/4885MEN1 3487/4885APAF1 1394/4885
US-20070066822-A1 Ionic liquids AFF2, AFF1, ZYX FDPS 2830/4885MEN1 1207/4885APAF1 3882/4885
US-20070066852-A1 Preparation of poly(tetramethylene) glycol PARG, PUF60, TPR FDPS 551/4885MEN1 322/4885APAF1 2585/4885

“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.