Iodide

Iodide

SCHEMBL4512602

COC(=O)c1ccc[n+](C)c1.[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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.44
NNMT P40261 1/20 0.59
USP2 O75604 1/20 0.59
APOBEC3A P31941 3/20 0.54
APOBEC3G Q9HC16 3/20 0.54
PABPC1 P11940 1/20 0.54
TSHR P16473 2/20 0.53
ALDH1A1 P00352 3/20 0.48
RECQL P46063 1/20 0.48
LMNA P02545 3/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ABL1 P00519 1/20 0.44
RIN1 Q13671 1/20 0.44
KDM4E B2RXH2 1/20 0.44
BCHE P06276 2/20 0.44
GLA P06280 2/20 0.44
MAPK1 P28482 1/20 0.44
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL3841152 0.98 NNMT (0.61) NNMTUSP2APOBEC3AAPOBEC3GPABPC1
Iodide SCHEMBL8724842 0.87 NNMT (0.61) NNMTUSP2APOBEC3AAPOBEC3GPABPC1
SCHEMBL8724844 0.85 NNMT (0.63) NNMTUSP2APOBEC3AAPOBEC3GPABPC1
SCHEMBL6514078 0.82 TCF4 (0.49) NNMTUSP2APOBEC3AAPOBEC3GPABPC1
SCHEMBL10307402 0.79 GLA (0.58) NNMTUSP2APOBEC3AAPOBEC3GTSHR
SCHEMBL12039197 0.78 TSHR (0.53) TSHRALDH1A1RECQLSMN1; SMN2ABL1
SCHEMBL5237493 0.78 TSHR (0.53) NNMTTSHRALDH1A1RECQLABL1
SCHEMBL2818943 0.78 ABL1 (0.67) TSHRALDH1A1RECQLABL1RIN1
SCHEMBL14067665 0.77 NNMT (0.54) NNMTUSP2APOBEC3AAPOBEC3GPABPC1
Iodide SCHEMBL21082042 0.77 NNMT (0.54) NNMTUSP2APOBEC3AAPOBEC3GPABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds LES LABORATOIRES SERVIER (FR) 2009-10-15 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-20090258883-A1 1H-Indole-Pyridinecarboxamide and 1H-Indole-Piperidinecarboxamide Compounds IDO1, AHR, IDO2 ACHE 1681/4885NNMT 1166/4885USP2 3146/4885

“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.