Bromide

Bromide

SCHEMBL5544787

C[N+]1(CCCOc2ccccc2)CC[C@H](OC(=O)C(O)(c2cccs2)c2cccs2)C1.[Br-]

nearest known ligand 0.67

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 12)

geneUniProtsupporting neighboursconfidence
CHRM3 known ✓ P20309 20/20 0.67
CHRM2 known ✓ P08172 16/20 0.67
CHRM1 known ✓ P11229 16/20 0.67
CHRM4 known ✓ P08173 2/20 0.67
CHRM5 known ✓ P08912 2/20 0.67
ADRA2A P08913 2/20 0.67
ADRA2C P18825 2/20 0.67
TACR1 P25103 2/20 0.67
ADRA1A P35348 2/20 0.67
HRH1 P35367 2/20 0.67
OPRK1 P41145 2/20 0.67
KCNH2 Q12809 2/20 0.67

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 SCHEMBL5532990 1.00 CHRM3 (0.67) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL5533379 1.00 CHRM3 (0.67) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL5540087 0.95 CHRM3 (0.63) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL5536849 0.95 CHRM3 (0.63) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL5540113 0.95 CHRM3 (0.63) CHRM3CHRM2CHRM1CHRM4CHRM5
Hydrochloric Acid SCHEMBL5536910 0.90 CHRM3 (0.56) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL1875867 0.90 CHRM3 (0.61) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL1875866 0.90 CHRM3 (0.61) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL1875238 0.90 CHRM3 (0.62) CHRM3CHRM2CHRM1CHRM4CHRM5
Bromide SCHEMBL1875236 0.90 CHRM3 (0.62) CHRM3CHRM2CHRM1CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070129420-A1 New pyrrolidinium derivatives ALMIRALL PRODESFARMA SA 2007-06-07 US claimed
US-7192978-B2 Pyrrolidinium derivatives ALMIRALL PRODESFARMA AG (CH) 2007-03-20 US claimed
US-20050282875-A1 Pyrrolidinium derivatives LABORATORIOS ALMIRALL S.A. (ES) 2005-12-22 US claimed
EP-1497284-A2 PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS Almirall Prodesfarma AG (CH) 2005-01-19 EP claimed
WO-2003087094-A2 PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS ALMIRALL PRODESFARMA AG (CH) 2003-10-23 WO claimed
US-20070129420-A1 New pyrrolidinium derivatives ALMIRALL PRODESFARMA SA 2007-06-07 US disclosed
EP-1497284-A2 PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS Almirall Prodesfarma AG (CH) 2005-01-19 EP disclosed
WO-2003087094-A2 PYRROLIDINIUM DERIVATIVES AS ANTAGONISTS OF M3 MUSCARINIC RECEPTORS ALMIRALL PRODESFARMA AG (CH) 2003-10-23 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-20050282875-A1 Pyrrolidinium derivatives CHRM3, CHRM2, CHRM1 CHRM3 1/4885CHRM2 2/4885CHRM1 3/4885
US-20070129420-A1 New pyrrolidinium derivatives CHRM3, CHRM2, CHRM1 CHRM3 1/4885CHRM2 2/4885CHRM1 3/4885

“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.