Iodide

Iodide

SCHEMBL3883538

C[S+]1CCN(c2ccc(NC(=O)C(=O)c3c(-c4ccccc4)cc4ccccn34)cc2)CC1.[I-]

nearest known ligand 0.56

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 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.56
MAPT P10636 6/20 0.56
LMNA P02545 3/20 0.56
HTT P42858 3/20 0.56
THRB P10828 1/20 0.53
SMN1; SMN2 Q16637 5/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
KMT2A Q03164 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
RAB9A P51151 5/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 3/20 0.38
MAPK1 P28482 1/20 0.38
NPC1 O15118 3/20 0.37
GAA P10253 1/20 0.37
RECQL P46063 1/20 0.36
NPY2R P49146 1/20 0.35

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
SCHEMBL1646722 0.99 ALDH1A1 (0.56) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1645570 0.88 MAPT (0.58) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1646045 0.87 MAPT (0.58) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1645536 0.87 MAPT (0.57) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1646414 0.86 MAPT (0.66) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1644926 0.85 MAPT (0.58) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1646413 0.85 MAPT (0.56) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1645535 0.85 MAPT (0.55) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL2231595 0.85 ALDH1A1 (0.55) ALDH1A1MAPTLMNAHTTTHRB
SCHEMBL1645576 0.84 MAPT (0.57) ALDH1A1MAPTLMNAHTTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486962-B2 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2013-07-16 US disclosed
EP-1888063-B1 ANTIFUNGAL AGENTS F2G LTD (GB) 2009-01-14 EP disclosed
US-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2008-07-03 US disclosed
EP-1888063-A1 ANTIFUNGAL AGENTS F2G Ltd. (GB) 2008-02-20 EP disclosed
WO-2006123145-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2006-11-23 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-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus NAT1, CYP1A2, CYP51A1 ALDH1A1 510/4885MAPT 2792/4885LMNA 2694/4885

“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.