Iodide

Iodide

SCHEMBL1502806

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

nearest known ligand 0.54

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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.37
HTT P42858 3/20 0.54
CHKA P35790 1/20 0.46
KDM4E B2RXH2 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TERT O14746 1/20 0.34
GLA P06280 1/20 0.34

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
SCHEMBL62492 0.97
Fluoride Ion SCHEMBL1502900 0.94 HTT (0.54) HTTCHKAKDM4ERAB9ASMN1; SMN2
Water SCHEMBL2149413 0.94 HTT (0.54) HTTCHKAKDM4ERAB9ASMN1; SMN2
Bromide SCHEMBL1502745 0.94 HTT (0.54) HTTCHKAKDM4ERAB9AACHE
Hydrochloric Acid SCHEMBL1502838 0.94 HTT (0.54) HTTCHKAKDM4ERAB9ASMN1; SMN2
SCHEMBL30329823 0.90 HTT (0.50) HTTCHKAKDM4ERAB9ASMN1; SMN2
SCHEMBL2150124 0.87 HTT (0.48) HTTCHKAKDM4ERAB9ASMN1; SMN2
Perchlorate SCHEMBL2150468 0.84 HTT (0.45) HTTCHKAKDM4ERAB9AALDH1A1
SCHEMBL16699884 0.84 HTT (0.45) HTTCHKAKDM4ERAB9ALMNA
Sulfuric Acid SCHEMBL21195058 0.82 HTT (0.44) HTTCHKAKDM4ESMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110183376-A For detecting fluorescence probe and its synthetic method and the application of human serum albumins 青岛科技大学 2019-08-30 CN claimed
US-11965100-B2 Aggregation-induced emission luminogens useful for cancer cell discrimination and monitoring THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2024-04-23 US disclosed
CN-113527256-B Aggregation-induced emission fluorescent agent for cancer cell identification and monitoring 香港科技大学 2024-02-06 CN disclosed
CN-113527256-A Fluorescence agent of aggregation-induced luminescence for cancer cell identification and monitoring 香港科技大学 2021-10-22 CN disclosed
US-20210324199-A1 AGGREGATION-INDUCED EMISSION LUMINOGENS USEFUL FOR CANCER CELL DISCRIMINATION AND MONITORING THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2021-10-21 US disclosed
CN-110183376-A For detecting fluorescence probe and its synthetic method and the application of human serum albumins 青岛科技大学 2019-08-30 CN disclosed
CN-110183376-A For detecting fluorescence probe and its synthetic method and the application of human serum albumins 青岛科技大学 2019-08-30 CN disclosed
EP-2295484-B1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM SAME POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL MITSUI CHEMICALS INC (JP) 2018-01-17 EP disclosed
US-9290656-B2 Polymerizable composition for polythiourethane optical material MITSUI CHEMICALS, INC. (JP) 2016-03-22 US disclosed
EP-2341091-B1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PREPARING THE OPTICAL MATERIAL MITSUI CHEMICALS INC (JP) 2013-12-04 EP disclosed
US-8434866-B2 Polymerizable composition for optical material, optical material, and method for preparing the optical material MITSUI CHEMICALS, INC. (JP) 2013-05-07 US disclosed
US-8304507-B2 Polymerizable composition for polythiourethane optical material, polythiourethane optical material obtained from the polymerizable composition, and polymerization catalyst for polythiourethane optical material MITSUI CHEMICALS, INC. (JP) 2012-11-06 US disclosed
US-20110190466-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2011-08-04 US disclosed
EP-2341091-A1 POLYMERIZABLE COMPOUND FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND OPTICAL MATERIAL MANUFACTURING METHOD Mitsui Chemicals, Inc. (JP) 2011-07-06 EP disclosed
US-20110112269-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM THE POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2011-05-12 US disclosed
EP-2295484-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYTHIOURETHANE OPTICAL MATERIAL OBTAINED FROM SAME POLYMERIZABLE COMPOSITION, AND POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2011-03-16 EP disclosed
US-20100075154-A1 POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIAL, OPTICAL MATERIAL, AND METHOD FOR PREPARING THE OPTICAL MATERIAL MITSUI CHEMICALS, INC. (JP) 2010-03-25 US disclosed
US-7629491-B2 Hydrocarboxylation process EASTMAN CHEMICAL COMPANY (US) 2009-12-08 US disclosed
EP-1988109-A1 POLYMERIZABLE COMPOSITION FOR POLYTHIOURETHANE OPTICAL MATERIAL Mitsui Chemicals, Inc. (JP) 2008-11-05 EP disclosed
US-20070299280-A1 forming propionic acid from ethylene, water and carbon monoxide; not using the hazardous and corrosive hydrogen halides or sulfonic acids; free of hydrogen iodide and/or ethyl iodide; no diethyl ketone by-products EASTMAN CHEMICAL COMPANY (US) 2007-12-27 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-20070299280-A1 forming propionic acid from ethylene, water and carbon monoxide; not using the hazardous and corrosive hydrogen halides or sulfonic acids; free of hydrogen iodide and/or ethyl iodide; no diethyl ketone by-products ETV6, ETV1, HAO2 ACHE 2565/4885HTT 3265/4885CHKA 199/4885

“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.