Bromide

Bromide

SCHEMBL310568

COc1cc(-c2cc[n+](CCF)cc2)ccc1[N+](=O)[O-].[Br-]

nearest known ligand 0.46

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 7)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 16/20 0.46
SIRT6 Q8N6T7 1/20 0.42
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39

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
SCHEMBL10266708 0.99 CHEK1 (0.46) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL10266656 0.87 CHEK1 (0.47) CHEK1SIRT6ALDH1A1LMNATDP1
Iodide SCHEMBL309744 0.86 CHEK1 (0.47) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL10258010 0.83 CHEK1 (0.46) CHEK1SIRT6ALDH1A1LMNATDP1
Bromide SCHEMBL2203274 0.82 CHEK1 (0.44) CHEK1SIRT6ALDH1A1LMNATDP1
Iodide SCHEMBL310926 0.82 CHEK1 (0.46) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL12429008 0.81 CHEK1 (0.45) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL25313062 0.81 CHEK1 (0.51) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL11224598 0.80 CHEK1 (0.61) CHEK1SIRT6ALDH1A1LMNATDP1
SCHEMBL359057 0.76 ALDH1A1 (0.61) CHEK1ALDH1A1LMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2162454-B1 IMIDAZOPYRIDINE KINASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-01-02 EP disclosed
US-8093239-B2 Imidazopyridine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2012-01-10 US disclosed
US-20100216779-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2010-08-26 US disclosed
EP-2162454-A1 IMIDAZOPYRIDINE KINASE INHIBITORS GlaxoSmithKline LLC (US) 2010-03-17 EP disclosed
WO-2008150799-A1 IMIDAZOPYRIDINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-12-11 WO disclosed
US-20080300242-A1 Imidazopyridine Kinase Inhibitors GLAXOSMITHKLINE LLC 2008-12-04 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 (2 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-20080300242-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 CHEK1 240/4885SIRT6 1497/4885ALDH1A1 3410/4885
US-20100216779-A1 Imidazopyridine Kinase Inhibitors ABL1, MAP3K19, MAP3K5 CHEK1 240/4885SIRT6 1497/4885ALDH1A1 3410/4885

“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.