Bromide

Bromide

SCHEMBL2815145

COCCOCC[N+]12CCC(CC1)[C@@H](O)C2.[Br-]

nearest known ligand 0.43

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 2)

geneUniProtsupporting neighboursconfidence
CHKA known ✓ P35790 1/20 0.43
CHRM3 known ✓ P20309 2/20 0.30

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
SCHEMBL4907268 0.89 CHKA (0.44) CHKACHRM3
Bromide SCHEMBL2818241 0.84 CHKA (0.44) CHKACHRM3
SCHEMBL4903168 0.82 CHKA (0.42) CHKACHRM3
SCHEMBL4906507 0.82 CHKA (0.42) CHKA
SCHEMBL4546743 0.70 CHKA (0.41) CHKACHRM3
Bromide SCHEMBL2816500 0.69 APOBEC3A (0.46) CHKACHRM3
SCHEMBL4903052 0.68 CHKA (0.42) CHKA
Iodide SCHEMBL30832965 0.68 RGS12 (0.36) CHRM3
SCHEMBL20663048 0.66 CHKA (0.35) CHKACHRM3
SCHEMBL4896775 0.62 KDM4E (0.40) CHKACHRM3

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
US-20100249420-A9 Process for preparing quinuclidinium carbamate derivatives LABORATORIOS ALMIRALL S.A. (ES) 2010-09-30 US disclosed
US-20090198064-A1 Process for preparing quinuclidinium carbamate derivatives LABORATORIOS ALMIRALL S.A. (ES) 2009-08-06 US disclosed
EP-1781651-B1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES ALMIRALL LAB (ES) 2009-03-11 EP disclosed
EP-1781651-A1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES Laboratorios Almirall, S.A. (ES) 2007-05-09 EP disclosed
WO-2006010452-A1 PROCESS FOR PREPARING QUINUCLIDINIUM CARBAMATE DERIVATIVES LABORATORIOS ALMIRALL, S.A. (ES) 2006-02-02 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 (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-20100249420-A9 Process for preparing quinuclidinium carbamate derivatives CPS1, NAAA, QPCT CHKA 423/4885CHRM3 549/4885
US-20090198064-A1 Process for preparing quinuclidinium carbamate derivatives CPS1, NAAA, QPCT CHKA 423/4885CHRM3 549/4885

“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.