Bromide

Bromide

SCHEMBL2917188

CN(N=Cc1cc[n+](CCCC[n+]2ccc(C=NN(C)c3ccccc3)c3ccccc32)c2ccccc12)c1ccccc1.[Br-].[Br-]

nearest known ligand 0.54

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
▸ CHKA known ✓ P35790 4/20 0.39
▸ ACHE known ✓ P22303 1/20 0.37
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ HTT P42858 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ NSD2 O96028 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ PPARG P37231 1/20 0.41
▸ RAD52 P43351 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
Bromide SCHEMBL2917182 1.00 MEN1 (0.41) MEN1KMT2AMAPTTDP1NPC1
Bromide SCHEMBL2923047 0.99 MEN1 (0.40) MEN1KMT2AMAPTTDP1NPC1
Bromide SCHEMBL2921613 0.99 MEN1 (0.40) MEN1KMT2AMAPTTDP1NPC1
Bromide SCHEMBL2921616 0.99 MEN1 (0.40) MEN1KMT2AMAPTTDP1NPC1
Bromide SCHEMBL2924313 0.99 MEN1 (0.40) MEN1KMT2AMAPTTDP1NPC1
SCHEMBL2913429 0.99 MEN1 (0.42) MEN1KMT2AMAPTTDP1NPC1
SCHEMBL2913432 0.99 MEN1 (0.42) MEN1KMT2AMAPTTDP1NPC1
Bromide SCHEMBL2921002 0.97 MEN1 (0.41) MEN1KMT2AMAPTTDP1NPC1
SCHEMBL2920381 0.97 MEN1 (0.41) MEN1KMT2AMAPTTDP1NPC1
SCHEMBL2912000 0.97 MEN1 (0.41) MEN1KMT2AMAPTTDP1NPC1

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 CHKA 1818/4885ACHE 3478/4885MEN1 1560/4885

“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.

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