Bromide

Bromide

SCHEMBL4456233

Cc1cs/c(=N\N=C\c2cc[n+](CCO)cc2)n1C.[Br-]

nearest known ligand 0.42

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 3/20 0.37
MAPT P10636 6/20 0.42
MEN1 O00255 6/20 0.42
KMT2A Q03164 6/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
LMNA P02545 3/20 0.42
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.42
MAPK1 P28482 3/20 0.42
THRB P10828 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 2/20 0.37
NPC1 O15118 4/20 0.36
TP53 P04637 3/20 0.36
RAB9A P51151 3/20 0.36
KDM4E B2RXH2 2/20 0.36
APAF1 O14727 1/20 0.35
HSP90AA1 P07900 1/20 0.35
BLM P54132 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
Bromide SCHEMBL4456235 1.00 MAPT (0.42) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3934049 0.83 MAPT (0.38) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3933201 0.82 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3934048 0.80 MAPT (0.38) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3933193 0.79 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2LMNA
Bromide SCHEMBL4455466 0.76 MAPT (0.57) MAPTMEN1KMT2ASMN1; SMN2LMNA
Bromide SCHEMBL4455472 0.76 MAPT (0.57) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3934653 0.72 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3943122 0.72 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL3934652 0.70 MAPT (0.37) MAPTMEN1KMT2ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488353-B2 Cationic heteroarylazine dyes and colorants containing these compounds WELLA AG (DE) 2009-02-10 US disclosed
US-20070174975-A1 Cationic heteroarylazine dyes and colorants containing these compounds Wella GmbH (DE) 2007-08-02 US disclosed
EP-1718705-A1 CATIONIC HETEROARYL AZINE DYES, AND DYEING AGENTS CONTAINING SAID COMPOUNDS Wella Aktiengesellschaft (DE) 2006-11-08 EP disclosed
WO-2005083009-A1 CATIONIC HETEROARYL AZINE DYES, AND DYEING AGENTS CONTAINING SAID COMPOUNDS WELLA AKTIENGESELLSCHAFT (DE) 2005-09-09 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 (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-20070174975-A1 Cationic heteroarylazine dyes and colorants containing these compounds KRT18, IK, CRYZ ACHE 2915/4885MAPT 1057/4885MEN1 4339/4885

“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.