Iodide

Iodide

SCHEMBL21519540

I.N=C(N/N=C/c1c(Cl)cccc1Cl)Nc1ccccc1

nearest known ligand 0.49

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
▸ FAAH O00519 1/20 0.49
▸ MGLL Q99685 1/20 0.49
▸ KMT2A Q03164 6/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ LMNA P02545 2/20 0.49
▸ NPC1 O15118 2/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ HTT P42858 2/20 0.49
▸ CYP1A2 P05177 4/20 0.47
▸ CYP2C19 P33261 4/20 0.47
▸ CYP3A4 P08684 3/20 0.47
▸ GRK2 P25098 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ GRK5 P34947 1/20 0.42
▸ GRK3 P35626 1/20 0.42
▸ MAPT P10636 3/20 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
SCHEMBL21538075 0.98 KMT2A (0.50) FAAHMGLLKMT2AMEN1LMNA
Iodide SCHEMBL21519538 0.90 FAAH (0.46) FAAHMGLLKMT2AMEN1LMNA
SCHEMBL19449739 0.84 POLB (0.60) FAAHMGLLKMT2AMEN1NPC1
Hydrochloric Acid SCHEMBL17560917 0.82 POLB (0.58) FAAHMGLLKMT2AMEN1NPC1
Iodide SCHEMBL21519406 0.80 POLB (0.65) FAAHMGLLKMT2AMEN1NPC1
Guanoxabenz SCHEMBL10409620 0.80 POLB (0.55) FAAHMGLLKMT2AMEN1NPC1
Guanoxabenz SCHEMBL122726 0.80 POLB (0.55) FAAHMGLLKMT2AMEN1NPC1
SCHEMBL21538097 0.78 HTT (0.67) FAAHMGLLKMT2AMEN1NPC1
SCHEMBL11582865 0.77 CYP1A2 (0.68) KMT2AMEN1LMNANPC1POLB
SCHEMBL11582862 0.77 CYP1A2 (0.68) KMT2AMEN1LMNANPC1POLB

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-12006294-B2 Therapeutic compounds REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2024-06-11 — — US disclosed
US-20190330157-A1 THERAPEUTIC COMPOUNDS REGENTS OF THE UNIVERSITY OF MINNESOTA 2019-10-31 — — 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 (2 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-20190330157-A1 THERAPEUTIC COMPOUNDS OPRL1, INA, OGFR FAAH 1724/4885MGLL 3811/4885KMT2A 3083/4885
US-12006294-B2 Therapeutic compounds OPRL1, INA, OGFR FAAH 1724/4885MGLL 3811/4885KMT2A 3083/4885

“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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