Bromide

Bromide

SCHEMBL2923830

CN(N=Cc1cc[n+](CCCC[n+]2ccc(C=NN(C)c3ccccc3)cc2)cc1)c1ccccc1.[Br-].[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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.46
CHKA known ✓ P35790 3/20 0.45
MAPT P10636 7/20 0.47
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPK1 P28482 2/20 0.47
APAF1 O14727 1/20 0.47
HSP90AA1 P07900 1/20 0.47
HTT P42858 1/20 0.47
BLM P54132 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HPGD P15428 1/20 0.45
TDP1 Q9NUW8 2/20 0.44
ALOX12 P18054 2/20 0.44
ALDH1A1 P00352 2/20 0.44
LMNA P02545 2/20 0.44
NFKB1 P19838 1/20 0.44

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
Bromide SCHEMBL2923013 1.00 MAPT (0.47) MAPTMEN1KMT2ASMN1; SMN2MAPK1
Bromide SCHEMBL2923046 0.98 MAPT (0.49) MAPTMEN1KMT2ASMN1; SMN2MAPK1
Bromide SCHEMBL2917838 0.98 MAPT (0.49) MAPTMEN1KMT2ASMN1; SMN2MAPK1
Bromide SCHEMBL2923043 0.98 MAPT (0.49) MAPTMEN1KMT2ASMN1; SMN2MAPK1
Bromide SCHEMBL2916602 0.98 MAPT (0.49) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL2920143 0.98 MEN1 (0.46) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL2920142 0.98 MEN1 (0.46) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL3024010 0.97 MEN1 (0.47) MAPTMEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL2920802 0.97 MEN1 (0.47) MAPTMEN1KMT2ASMN1; SMN2MAPK1
Bromide SCHEMBL2919575 0.97 ACHE (0.50) MAPTMEN1KMT2ASMN1; SMN2MAPK1

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
EP-1647548-B1 Dictionic bishydrazones, dyeingcompositions containig at least one of these compounds, process of their preparation and uses thereoff OREAL (FR) 2010-08-25 EP claimed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 US claimed
US-20060096043-A1 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2006-05-11 US claimed
US-7410506-B2 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2008-08-12 US disclosed
US-20060096043-A1 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof L'OREAL S.A. (FR) 2006-05-11 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-20060096043-A1 Dicationic bis-hydrazone compound, dye composition comprising at least one such compound, implementation process therefor and uses thereof KRT18, DSC1, DSG1 ACHE 3478/4885CHKA 1818/4885MAPT 1162/4885

“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.