Bromide

Bromide

SCHEMBL2562587

CCOP(=O)(CCC[n+]1ccc(C)cc1)OCC.[Br-]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.47
PPARD Q03181 1/20 0.39
MEN1 O00255 1/20 0.36
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
UBE2N P61088 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 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
SCHEMBL13411417 0.98 HTT (0.49) HTTPPARDTSHR
Bromide SCHEMBL31354627 0.89 MEN1 (0.46) HTTPPARDMEN1MAPTKMT2A
SCHEMBL14929645 0.84 HTT (0.47) HTTMEN1GLAMAPTMAPK1
SCHEMBL17817524 0.78 GGPS1 (0.48) HTTMEN1MAPTKMT2ASMN1; SMN2
Bromide SCHEMBL193632 0.70 HTT (0.79) HTTMEN1MAPTMAPK1KMT2A
Bromide SCHEMBL30903821 0.70 HTT (0.78) HTTMEN1MAPTKMT2A
Bromide SCHEMBL26090899 0.70 HTT (0.78) HTTMEN1MAPTKMT2A
SCHEMBL5017294 0.70 PPARD (0.64) PPARDTSHR
SCHEMBL7268189 0.70 PPARD (0.64) PPARDTSHR
SCHEMBL18234751 0.70 HTT (0.70) HTTMEN1MAPTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2982245-B1 CYANINE DYES FOR LABELING OF TARGET MOLECULES, IDENTIFICATION OF ORGANELLES AND OTHER APPLICATIONS ENZO LIFE SCIENCES INC (US) 2018-08-08 EP disclosed
EP-2982245-A1 LABELING OF TARGET MOLECULES, IDENTIFICATION OF ORGANELLES AND OTHER APPLICATIONS, NOVEL COMPOSITIONS, METHODS AND KITS Enzo Life Sciences, Inc. (US) 2016-02-10 EP disclosed
EP-2381783-B1 LABELING OF TARGET MOLECULES, IDENTIFICATION OF ORGANELLES AND OTHER APPLICATIONS, NOVEL COMPOSITIONS, METHODS AND KITS ENZO LIFE SCIENCES INC (US) 2015-09-02 EP disclosed
US-8674102-B2 Fluorescent dyes ENZO LIFE SCIENCES, INC. (US) 2014-03-18 US disclosed
US-8604204-B2 Fluorescent dyes ENZO LIFE SCIENCES, INC. (US) 2013-12-10 US disclosed
US-20130217059-A1 FLUORESCENT DYES ENZO LIFE SCIENCES, INC. (US) 2013-08-22 US disclosed
US-20130209994-A1 FLUORESCENT DYES ENZO LIFE SCIENCES, INC. (US) 2013-08-15 US disclosed
US-8476443-B2 Fluorescent dyes ENZO LIFE SCIENCES, INC. (US) 2013-07-02 US disclosed
US-20130115651-A1 FLUORESCENT DYES ENZO BIOCHEM, INC. (US) 2013-05-09 US disclosed
US-8362250-B2 Fluorescent dyes and compounds, methods and kits useful for identifying specific organelles and regions in cells of interest ENZO BIOCHEM, INC. (US) 2013-01-29 US disclosed
US-8357801-B2 Labeling of target molecules, identification of organelles and other applications, novel compositions, methods and kits ENZO LIFE SCIENCES, INC. (US) 2013-01-22 US disclosed
EP-2381783-A1 LABELING OF TARGET MOLECULES, IDENTIFICATION OF ORGANELLES AND OTHER APPLICATIONS, NOVEL COMPOSITIONS, METHODS AND KITS Enzo Life Sciences, Inc. (US) 2011-11-02 EP disclosed
WO-2010065918-A1 LABELING OF TARGET MOLECULES, IDENTIFICATION OF ORGANELLES AND OTHER APPLICATIONS, NOVEL COMPOSITIONS, METHODS AND KITS ENZO LIFE SCIENCES, INC. (US) 2010-06-10 WO disclosed
US-20100068752-A1 Novel fluorescent dyes and compounds, methods and kits useful for identifying specific organelles and regions in cells of interest ENZO LIFE SCIENCES, INC. 2010-03-18 US disclosed
US-20090226954-A1 Labeling of target molecules, identification of organelles and other applications, novel compositions, methods and kits ENZO LIFE SCIENCES, INC. 2009-09-10 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 (3 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-20090226954-A1 Labeling of target molecules, identification of organelles and other applications, novel compositions, methods and kits SSBP1, IMMT, DNAJA3 HTT 993/4885PPARD 2987/4885MEN1 3282/4885
US-20130115651-A1 FLUORESCENT DYES ANXA5, SSBP1, IARS1 HTT 539/4885PPARD 3092/4885MEN1 3539/4885
US-20100068752-A1 Novel fluorescent dyes and compounds, methods and kits useful for identifying specific organelles and regions in cells of interest SSBP1, YARS1, ANXA5 HTT 672/4885PPARD 2600/4885MEN1 3286/4885

“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.