Iodide

Iodide

SCHEMBL5143883

CCCCn1c(C)[n+](C)c2ccccc21.[I-]

nearest known ligand 0.47

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
ATM Q13315 1/20 0.47
RGS12 O14924 2/20 0.46
APOBEC3A P31941 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
TLR8 Q9NR97 3/20 0.45
PTPN1 P18031 2/20 0.45
PGR P06401 1/20 0.43
RORA P35398 1/20 0.43
RORC P51449 1/20 0.43
RORB Q92753 1/20 0.43
TSHR P16473 2/20 0.42
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL16343178 0.98 ATM (0.48) ATMRGS12APOBEC3AAPOBEC3GTLR8
SCHEMBL15156669 0.88 ATM (0.50) ATMRGS12APOBEC3AAPOBEC3GPTPN1
Iodide SCHEMBL25434164 0.81 PTPN1 (0.56) ATMTLR8PTPN1PGRRORA
SCHEMBL3457692 0.81 ATM (0.52) ATMRGS12APOBEC3AAPOBEC3GPTPN1
SCHEMBL25387252 0.79 PTPN1 (0.54) ATMTLR8PTPN1PGRRORA
SCHEMBL12532383 0.78 PKM (0.48) RGS12APOBEC3AAPOBEC3GTLR8PGR
Water SCHEMBL25434773 0.78 PTPN1 (0.52) ATMTLR8PTPN1PGRRORA
SCHEMBL18334841 0.77 LMNA (0.54) TLR8TSHRPKMSMN1; SMN2ALDH1A1
Iodide SCHEMBL5146463 0.75 ERAP1 (0.46) TLR8TSHRSMN1; SMN2TDP1L3MBTL1
SCHEMBL10028744 0.74 PTPN1 (0.48) ATMRGS12APOBEC3AAPOBEC3GTLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7273953-B2 Process for producing arylamine FUJIFILM FINECHEMICALS CO., LTD. (JP) 2007-09-25 US disclosed
US-20060069287-A1 Process for producing arylamine FUJIFILM FINECHEMICALS CO., LTD. (JP) 2006-03-30 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-20060069287-A1 Process for producing arylamine TYR, AADAC, AOC2 ATM 3066/4885RGS12 4023/4885APOBEC3A 66/4885

“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.