Iodide

Iodide

SCHEMBL5574532

CCC(O)C(N)(CC)CC.I

nearest known ligand 0.46

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 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46

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
SCHEMBL669679 0.97 TSHR (0.48) TSHR
Hydrochloric Acid SCHEMBL27874469 0.94 TSHR (0.46) TSHR
Water SCHEMBL141741 0.94 TSHR (0.46) TSHR
SCHEMBL6847292 0.90 TSHR (0.42) TSHR
Formic Acid SCHEMBL3678404 0.85 TSHR (0.39) TSHR
Acetic Acid SCHEMBL27811256 0.85 TSHR (0.39) TSHR
Silicate SCHEMBL6847289 0.85 TSHR (0.39) TSHR
SCHEMBL11880292 0.84 TSHR (0.42) TSHR
SCHEMBL2337550 0.78 TSHR (0.33) TSHR
SCHEMBL15204261 0.78 TSHR (0.46) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776125-A2 FUNCTIONALIZED SINGLE WALLED CARBON NANOTUBES HYPERION CATALYSIS INTERNATIONAL, INC. (US) 2007-04-25 EP disclosed
WO-2006130150-A2 FUNCTIONALIZED SINGLE WALLED CARBON NANOTUBES HYPERION CATALYSIS INTERNATIONAL, INC. (US) 2006-12-07 WO disclosed
EP-0910340-A4 FUNCTIONALIZED NANOTUBES HYPERION CATALYSIS INT (US) 2004-11-17 EP disclosed
US-20040202603-A1 graphitic nanotubes substituted with chemical moieties or upon which certain cyclic compounds are adsorbed; complex structures comprised of such functionalized fibrils linked to one another; introducing functional groups onto the surface of such fibrils HYPERION CATALYSIS INTERNATIONAL, INC. 2004-10-14 US disclosed
CN-1217653-A Functionalized nanotubes HYPERION CATALYSIS INT (US) 1999-05-26 CN disclosed
EP-0910340-A1 FUNCTIONALIZED NANOTUBES HYPERION CATALYSIS INTERNATIONAL, INC. (US) 1999-04-28 EP disclosed
WO-1997032571-A1 FUNCTIONALIZED NANOTUBES HYPERION CATALYSIS INTERNATIONAL, INC. (US) 1997-09-12 WO 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-20040202603-A1 graphitic nanotubes substituted with chemical moieties or upon which certain cyclic compounds are adsorbed; complex structures comprised of such functionalized fibrils linked to one another; introducing functional groups onto the surface of such fibrils FSCN1, CYCS, TUBA3C TSHR 4354/4885

“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.