Bromide

Bromide

SCHEMBL4451997

Br.Nc1cnc2c(O)c(Cl)cc(Cl)c2c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 2/20 0.50
HTR1A known ✓ P08908 1/20 0.50
MAPT P10636 5/20 0.50
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 4/20 0.50
HTT P42858 4/20 0.50
KMT2A Q03164 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
TDP1 Q9NUW8 4/20 0.50
HSP90AA1 P07900 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MMP14 P50281 3/20 0.50
OPRK1 P41145 3/20 0.50
LMNA P02545 3/20 0.50
CYP3A4 P08684 3/20 0.50
TP53 P04637 2/20 0.50
ALOX15 P16050 2/20 0.50
ALOX12 P18054 2/20 0.50
ALOX15B O15296 1/20 0.50
NR1I2 O75469 1/20 0.50

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
SCHEMBL4448881 0.98 MAPT (0.51) MAPTKDM4EMEN1HTTKMT2A
SCHEMBL4451993 0.79 MAPT (0.55) MAPTKDM4EMEN1HTTKMT2A
SCHEMBL4451241 0.72 PDE5A (0.41) MAPTKDM4EMEN1HTTKMT2A
SCHEMBL25328672 0.67 MAPT (0.51) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL3350 0.67 KDM4E (1.00) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL29389908 0.67 KDM4E (1.00) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL29399997 0.67 KDM4E (1.00) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL9135479 0.66 KDM4E (0.96) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL231205 0.66 KDM4E (0.96) MAPTKDM4EMEN1HTTKMT2A
Chloroxine SCHEMBL22734873 0.66 KDM4E (0.96) MAPTKDM4EMEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9302993-B2 8-hydroxy quinoline derivatives PRANA BIOTECHNOLOGY LIMITED (AU) 2016-04-05 US disclosed
US-20150335635-A1 8-HYDROXY QUINOLINE DERIVATIVES PRANA BIOTECHNOLOGY LIMITED (AU) 2015-11-26 US disclosed
US-9169211-B2 8-hydroxy quinoline derivatives PRANA BIOTECHNOLOGY LIMITED (AU) 2015-10-27 US disclosed
US-20150094334-A1 8-HYDROXY QUINOLINE DERIVATIVES PRANA BIOTECHNOLOGY LIMITED (AU) 2015-04-02 US disclosed
US-8975278-B2 8-hydroxy quinoline derivatives PRANA BIOTECHNOLOGY LIMITED (AU) 2015-03-10 US disclosed
US-20150025108-A1 8-HYDROXY QUINOLINE DERIVATIVES PRANA BIOTECHNOLOGY LIMITED (AU) 2015-01-22 US disclosed
US-7619091-B2 Treating nervous system disorders such as mild cognitive impairment, Alzheimer's disease or dementia associated with Down syndrome; e.g. use of 5,7-dichloro-8-hydroxy-2-(2-pyridyl)-quinoline (PBT 1052) PRANA BIOTECHNOLOGY LIMITED (AU) 2009-11-17 US disclosed
US-20080161353-A1 8-Hydroxy quinoline derivatives PRANA BIOTECHNOLOGY LIMITED (AU) 2008-07-03 US disclosed
EP-1539700-A4 8-HYDROXY QUINOLINE DERIVATIVES PRANA BIOTECHNOLOGY LTD (AU) 2006-06-28 EP disclosed
US-20060089380-A1 8-Hydroxy quinoline derivatives PRANA BIOTECHNOLOGY LTD. (AU) 2006-04-27 US disclosed
EP-1539700-A1 8-HYDROXY QUINOLINE DERIVATIVES Prana Biotechnology Ltd (AU) 2005-06-15 EP disclosed
WO-2004007461-A1 8-HYDROXY QUINOLINE DERIVATIVES PRANA BIOTECHNOLOGY LIMITED (AU) 2004-01-22 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 (5 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-20150335635-A1 8-HYDROXY QUINOLINE DERIVATIVES PARK7, COQ8A, NLN SLC6A2 5/4885HTR1A 113/4885MAPT 170/4885
US-20080161353-A1 8-Hydroxy quinoline derivatives PARK7, COQ8A, NLN SLC6A2 5/4885HTR1A 113/4885MAPT 170/4885
US-20150025108-A1 8-HYDROXY QUINOLINE DERIVATIVES PARK7, COQ8A, NLN SLC6A2 5/4885HTR1A 113/4885MAPT 170/4885
US-20060089380-A1 8-Hydroxy quinoline derivatives PARK7, HTT, SNCA SLC6A2 79/4885HTR1A 119/4885MAPT 122/4885
US-20150094334-A1 8-HYDROXY QUINOLINE DERIVATIVES PARK7, COQ8A, NLN SLC6A2 5/4885HTR1A 113/4885MAPT 170/4885

“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.