Bromide

Bromide

SCHEMBL4522009

C[N+](C)(C)C1CC[C@@H](OC(=O)[C@](O)(c2ccccc2)[C@@H]2CCC(F)(F)C2)C1.[Br-]

nearest known ligand 0.49

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 8)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 19/20 0.49
CHRM1 known ✓ P11229 19/20 0.49
CHRM3 known ✓ P20309 19/20 0.49
CHRM4 known ✓ P08173 1/20 0.45
CHRM5 known ✓ P08912 1/20 0.45
HRH1 P35367 1/20 0.45
HTR2B P41595 1/20 0.45
KCNH2 Q12809 1/20 0.45

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 SCHEMBL4522005 1.00 CHRM2 (0.49) CHRM2CHRM1CHRM3CHRM4CHRM5
Bromide SCHEMBL4533205 0.95 CHRM2 (0.50) CHRM2CHRM1CHRM3CHRM4CHRM5
SCHEMBL6398235 0.84 CHRM2 (0.59) CHRM2CHRM1CHRM3
SCHEMBL4534152 0.84 CHRM2 (0.51) CHRM2CHRM1CHRM3
SCHEMBL6398253 0.84 CHRM2 (0.59) CHRM2CHRM1CHRM3
SCHEMBL6398238 0.84 CHRM2 (0.59) CHRM2CHRM1CHRM3
SCHEMBL4534154 0.84 CHRM2 (0.51) CHRM2CHRM1CHRM3
Bromide SCHEMBL4530799 0.82 CHRM2 (0.48) CHRM2CHRM1CHRM3
Bromide SCHEMBL4530805 0.82 CHRM2 (0.48) CHRM2CHRM1CHRM3
Bromide SCHEMBL4508480 0.81 CHRM3 (0.63) CHRM2CHRM1CHRM3CHRM4CHRM5

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
US-7504432-B2 Ester derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-03-17 US disclosed
US-20070129397-A1 Ester derivatives MSD K.K. (JP) 2007-06-07 US disclosed
US-7192969-B2 Ester derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-03-20 US disclosed
US-20050065211-A1 Ester derivatives MSD K.K. (JP) 2005-03-24 US disclosed
US-6846835-B2 Treating chronic obstructive pulmonary disease, chronic bronchitis, asthma, chronic respiratory tract obstruction, fibroid lung, pulmonary emphysema or rhinitis BANYU PHARMACEUTICAL CO., LTD. (JP) 2005-01-25 US disclosed
US-20030191316-A1 Ester derivatives MSD K.K. (JP) 2003-10-09 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 (3 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-20070129397-A1 Ester derivatives CHRM3, CHRM2, CHRM1 CHRM2 2/4885CHRM1 3/4885CHRM3 1/4885
US-20030191316-A1 Ester derivatives CHRM3, CHRM2, CHRM1 CHRM2 2/4885CHRM1 3/4885CHRM3 1/4885
US-20050065211-A1 Ester derivatives CHRM3, CHRM2, CHRM1 CHRM2 2/4885CHRM1 3/4885CHRM3 1/4885

“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.