Iodide

Iodide

SCHEMBL3053673

CC[n+]1c(C)sc2c3ccccc3ccc21.[I-]

nearest known ligand 0.58

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
▸ MAPT P10636 8/20 0.58
▸ KDM4E B2RXH2 7/20 0.47
▸ RAB9A P51151 5/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ MAPK1 P28482 3/20 0.47
▸ PKM P14618 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ LMNA P02545 2/20 0.46
▸ MPI P34949 1/20 0.46
▸ PRMT1 Q99873 4/20 0.45
▸ POLB P06746 2/20 0.42
▸ HTT P42858 5/20 0.42
▸ ALDH1A1 P00352 4/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ MITF O75030 1/20 0.39
▸ NPC1 O15118 4/20 0.38
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ GAA P10253 3/20 0.38
▸ GLA P06280 1/20 0.38

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
SCHEMBL13979716 0.98 MAPT (0.56) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL8007151 0.84 MAPT (0.44) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL15743862 0.80 MAPT (0.56) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL13646893 0.77 HSD17B10 (0.59) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL13851440 0.77 ALDH1A1 (0.53) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL8796498 0.76 MAPT (0.36) MAPTKDM4ERAB9AMEN1KMT2A
Iodide SCHEMBL10803441 0.74 PRMT1 (0.43) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL12327828 0.74 KDM4E (0.37) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL4830357 0.73 KDM4E (0.55) MAPTKDM4ERAB9AMEN1KMT2A
SCHEMBL12194208 0.73 MAPT (0.46) MAPTKDM4EPKMLMNAMPI

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
US-20100222580-A1 Process For The Preparation Of Onium Alkylsulfates Having A Low Halide Content MERCK PATENT GMBH (DE) 2010-09-02 — — US disclosed
EP-1828142-B1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT MERCK PATENT GMBH (DE) 2010-06-02 — — EP disclosed
EP-1828142-A1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT Merck Patent GmbH (DE) 2007-09-05 — — EP disclosed
WO-2006063654-A1 METHOD FOR PRODUCING ONIUM ALKYL SULFATES WITH A LOW HALOGENIDE CONTENT MERCK PATENT GMBH (DE) 2006-06-22 — — WO disclosed
US-4713316-A INFRARED SENSITIZING DYES, MOBILE DYE PRECURSORS, ALKALI, SILVER HALIDE EMULSION FUJI PHOTO FILM CO., LTD. (JP) 1987-12-15 — — 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-20100222580-A1 Process For The Preparation Of Onium Alkylsulfates Having A Low Halide Content STS, MRPS35, ARSA MAPT 4654/4885KDM4E 733/4885RAB9A 3090/4885

“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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