Bromide

Bromide

SCHEMBL5132009

Br.CCCc1nc2ccccn2c(=O)c1Br

nearest known ligand 0.51

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 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
ADORA1 P30542 1/20 0.43
ATM Q13315 1/20 0.41

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
SCHEMBL3955368 0.99 MAPT (0.52) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL3959035 0.90 MAPT (0.60) MAPTKDM4EALDH1A1TDP1GLA
Bromide SCHEMBL3957044 0.88 KDM4E (0.50) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL3090839 0.87 KDM4E (0.51) MAPTKDM4EALDH1A1TDP1GLA
Bromide SCHEMBL3958091 0.86 MAPT (0.43) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL2715301 0.84 MAPT (0.46) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL3959722 0.83 POLB (0.47) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL890546 0.81 KDM4E (0.47) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL890574 0.81 KDM4E (0.47) MAPTKDM4EALDH1A1TDP1GLA
SCHEMBL12844018 0.80 KDM4E (0.66) MAPTKDM4EALDH1A1TDP1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS XENON PHARMACEUTICALS INC. (CA) 2008-08-14 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 (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-20080194616-A1 PYRIDOPYRIMIDINONE COMPOUNDS USEFUL IN TREATING SODIUM CHANNEL-MEDIATED DISEASES OR CONDITIONS SCN1A, SCN3A, SCN1B MAPT 183/4885KDM4E 3846/4885ALDH1A1 1009/4885

“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.