Iodide

Iodide

SCHEMBL565628

CC1N(CCCCCCC(=O)O)c2ccccc2C1(C)C.I

nearest known ligand 0.40

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
GAA P10253 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
PTGIR P43119 3/20 0.39
HDAC1 Q13547 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
MAPT P10636 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC7 Q8WUI4 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC10 Q969S8 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC9 Q9UKV0 1/20 0.38
HDAC5 Q9UQL6 1/20 0.38
PTGER4 P35408 6/20 0.37

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
SCHEMBL25230632 0.99 GAA (0.41) GAAFABP4FABP5DRD2DRD4
Bromide SCHEMBL7649880 0.97 GAA (0.40) GAAFABP4FABP5DRD2DRD4
Bromide SCHEMBL5034614 0.97 GAA (0.40) GAAFABP4FABP5DRD2DRD4
SCHEMBL14454734 0.97 FABP4 (0.41) GAAFABP4FABP5DRD2DRD4
Iodide SCHEMBL3454461 0.89 DRD2 (0.42) FABP4FABP5DRD2DRD4HDAC1
SCHEMBL29521317 0.88 DRD2 (0.43) FABP4FABP5DRD2DRD4HDAC1
SCHEMBL5133368 0.88 DRD2 (0.43) FABP4FABP5DRD2DRD4HDAC1
SCHEMBL21768355 0.87 DRD2 (0.39) GAADRD2DRD4HDAC1HDAC6
Bromide SCHEMBL28672149 0.87 DRD2 (0.42) FABP4FABP5DRD2DRD4HDAC1
Bromide SCHEMBL5833274 0.87 DRD2 (0.42) FABP4FABP5DRD2DRD4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802710-B1 METHODS FOR FORMING DYED MICROSPHERES AND POPULATIONS OF DYED MICROSPHERES LUMINEX CORP (US) 2016-02-24 EP disclosed
EP-2559738-B1 Methods for forming dyed microspheres and populations of dyed microspheres LUMINEX CORP (US) 2014-07-09 EP disclosed
EP-2559738-A1 Methods for forming dyed microspheres and populations of dyed microspheres Luminex Corporation (US) 2013-02-20 EP disclosed
US-8361169-B2 Methods for forming dyed microspheres and populations of dyed microspheres LUMINEX CORPORATION (US) 2013-01-29 US disclosed
US-20120035328-A1 METHODS FOR FORMING DYED MICROSPHERES AND POPULATIONS OF DYED MICROSPHERES HOFFACKER KURT D (US) 2012-02-09 US disclosed
US-8038734-B2 Methods for forming dyed microspheres and populations of dyed microspheres LUMINEX CORPORATION (US) 2011-10-18 US disclosed
EP-1802710-A2 METHODS FOR FORMING DYED MICROSPHERES AND POPULATIONS OF DYED MICROSPHERES Luminex Corporation (US) 2007-07-04 EP disclosed
US-20060085925-A1 Methods for forming dyed microspheres and populations of dyed microspheres LUMINEX CORPORATION 2006-04-27 US disclosed
WO-2006044413-A2 METHODS FOR FORMING DYED MICROSPHERES AND POPULATIONS OF DYED MICROSPHERES LUMINEX CORPORATION (US) 2006-04-27 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-20120035328-A1 METHODS FOR FORMING DYED MICROSPHERES AND POPULATIONS OF DYED MICROSPHERES CD68, CD14, MYADM GAA 712/4885FABP4 1241/4885FABP5 598/4885

“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.