Iodide

Iodide

SCHEMBL3580170

CSC(=N)c1ccc2c(c1)Nc1ccccc1S2.I

nearest known ligand 0.61

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 0.49
NOX1 Q9Y5S8 12/20 0.61
GAA P10253 8/20 0.61
MAPT P10636 8/20 0.61
MEN1 O00255 5/20 0.61
KMT2A Q03164 5/20 0.61
ALOX15 P16050 2/20 0.61
SNCA P37840 2/20 0.61
CYBB P04839 2/20 0.61
NOX3 Q9HBY0 2/20 0.61
NOX4 Q9NPH5 2/20 0.61
APP P05067 1/20 0.61
KCNH2 Q12809 2/20 0.51
NPSR1 Q6W5P4 3/20 0.49
MAPK1 P28482 2/20 0.49
LMNA P02545 2/20 0.49
BCHE P06276 2/20 0.49
POLB P06746 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49

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
SCHEMBL3586107 0.99 NOX1 (0.62) NOX1GAAMAPTMEN1KMT2A
SCHEMBL13269666 0.79 NOX1 (0.63) NOX1GAAMAPTMEN1KMT2A
SCHEMBL29375737 0.76 NOX1 (1.00) NOX1GAAMAPTMEN1KMT2A
Phenothiazine SCHEMBL28073776 0.76 NOX1 (1.00) NOX1GAAMAPTMEN1KMT2A
SCHEMBL342449 0.76 NOX1 (1.00) NOX1GAAMAPTMEN1KMT2A
SCHEMBL3573034 0.76 NOX1 (0.56) NOX1GAAMAPTMEN1KMT2A
SCHEMBL3573032 0.76 NOX1 (0.56) NOX1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL3587396 0.75 NOX1 (0.54) NOX1GAAMAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL3587395 0.75 NOX1 (0.54) NOX1GAAMAPTMEN1KMT2A
SCHEMBL3586011 0.74 NOX1 (0.74) NOX1GAAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642591-B2 Composition containing amidine derivatives or carboxamide derivatives and steroids, as a medicament IPSEN PHARMA S.A.S. (FR) 2014-02-04 US disclosed
US-7659266-B2 Amidine derivatives and their applications as a medicament S.C.R.A.S. (FR) 2010-02-09 US disclosed
US-20090018120-A1 AMIDINE DERIVATIVES AND THEIR APPLICATIONS AS A MEDICAMENT SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (FR) 2009-01-15 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-20090018120-A1 AMIDINE DERIVATIVES AND THEIR APPLICATIONS AS A MEDICAMENT CAPN2, CAPN9, CAPN1 ACHE 616/4885NOX1 196/4885GAA 340/4885

“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.