Iodide

Iodide

SCHEMBL3822941

Cc1ccc(N2c3ccccc3N(C)C2C(=O)O)cc1C.I

nearest known ligand 0.39

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
▸ STING1 Q86WV6 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ STAT1 P42224 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ TSHR P16473 1/20 0.37
▸ CA1 P00915 3/20 0.37
▸ CA2 P00918 3/20 0.37
▸ CES2 O00748 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ ALKBH5 Q6P6C2 1/20 0.36
▸ CCR1 P32246 1/20 0.35
▸ CCR2 P41597 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 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
SCHEMBL29843930 0.99 STING1 (0.40) STING1MEN1KMT2ASTAT1ALDH1A1
Iodide SCHEMBL2347798 0.84 HDAC4 (0.36) ALDH1A1NOTUMPOLBNPSR1GAA
Iodide SCHEMBL2347792 0.84 HDAC4 (0.36) ALDH1A1NOTUMPOLBNPSR1GAA
Iodide SCHEMBL1928828 0.83 HTR3A (0.41) STING1ALDH1A1TSHR
SCHEMBL29843820 0.82 HDAC4 (0.37) ALDH1A1NOTUMPOLBNPSR1GAA
SCHEMBL28954321 0.75 MEN1 (0.42) STING1MEN1KMT2AALDH1A1TSHR
SCHEMBL28283765 0.75 HDAC4 (0.43) ALDH1A1TSHRNOTUMMAPT
SCHEMBL18324318 0.72 CCR1 (0.46) MEN1KMT2AALDH1A1CES2CES1
SCHEMBL28979084 0.65 CASP1 (0.37) MEN1KMT2APOLBGAA
SCHEMBL28285349 0.64 CSNK2A1 (0.40) MEN1KMT2ATSHRNOTUMPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11404650-B2 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2022-08-02 — — US disclosed
US-10381579-B2 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2019-08-13 — — US disclosed
US-20150249225-A1 STABILITY OLED MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2015-09-03 — — US disclosed
US-9051344-B2 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2015-06-09 — — US disclosed
US-7902374-B2 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2011-03-08 — — US disclosed
EP-1878053-B1 STABILITY OLED MATERIALS AND DEVICES WITH IMPROVED STABILITY UNIVERSAL DISPLAY CORP (US) 2009-08-26 — — EP disclosed
US-7534505-B2 Organometallic compounds for use in electroluminescent devices THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-05-19 — — US disclosed
WO-2008054584-A1 IMPROVED STABILITY OLED MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2008-05-08 — — WO disclosed
US-20070088167-A1 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION 2007-04-19 — — US disclosed
US-20060251923-A1 Stability OLED materials and devices UNIVERSAL DISPLAY CORPORATION 2006-11-09 — — US disclosed
US-20050260448-A1 Novel organometallic compounds for use in electroluminescent devices UNIVERSAL DISPLAY CORPORATION 2005-11-24 — — 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 (3 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-11404650-B2 Stability OLED materials and devices OCIAD2, OCIAD1, OSBP2 STING1 4212/4885MEN1 3298/4885KMT2A 2787/4885
US-10381579-B2 Stability OLED materials and devices OCIAD2, OCIAD1, OSBP2 STING1 4225/4885MEN1 3324/4885KMT2A 2798/4885
US-20150249225-A1 STABILITY OLED MATERIALS AND DEVICES OCIAD2, OCIAD1, OSBP2 STING1 4225/4885MEN1 3324/4885KMT2A 2798/4885

“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.

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