Bromide

Bromide

SCHEMBL1885173

CCCC(CCc1ccc(CC)cc1C(=O)O)[n+]1cc[nH]c1.[Br-]

nearest known ligand 0.35

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
▸ ALDH1A1 P00352 3/20 0.35
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ SLC16A3 O15427 1/20 0.33
▸ KAT8 Q9H7Z6 2/20 0.33
▸ METAP2 P50579 2/20 0.33
▸ PPARG P37231 4/20 0.33
▸ PPARD Q03181 3/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ USP2 O75604 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ PPARA Q07869 3/20 0.31
▸ BRS3 P32247 1/20 0.31
▸ MCL1 Q07820 1/20 0.30
▸ CA12 O43570 1/20 0.30
▸ ALPL P05186 1/20 0.30
▸ CA9 Q16790 1/20 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
Bromide SCHEMBL1880768 0.94 KAT8 (0.36) ALDH1A1SLC16A3KAT8METAP2PPARG
Bromide SCHEMBL1882341 0.92 KAT8 (0.40) ALDH1A1SLC16A3KAT8PPARGMEN1
Bromide SCHEMBL1894117 0.76 SLC16A3 (0.37) ALDH1A1SLC16A3KAT8METAP2MEN1
Bromide SCHEMBL1885972 0.71 POLB (0.35) KMT2A
Bromide SCHEMBL506424 0.71 — —
SCHEMBL3388697 0.69 ALDH1A1 (0.52) ALDH1A1KAT8METAP2MEN1USP2
SCHEMBL3554363 0.69 — —
SCHEMBL6882585 0.67 NPSR1 (0.46) ALDH1A1KAT8METAP2PPARGPPARD
SCHEMBL506437 0.67 — —
Bromide SCHEMBL1881898 0.65 GABRA1 (0.39) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9260397-B2 Salts comprising aryl-alkyl-substituted imidazolium and triazolium cations and the use thereof TECHNISCHE UNIVERSITAET DRESDEN (DE) 2016-02-16 — — US disclosed
US-20110105761-A1 Salts Comprising Aryl-Alkyl-Substituted Imidazolium and Triazolium Cations and the Use Thereof TECHNISCHE UNIVERSITAET DRESDEN (DE) 2011-05-05 — — 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 (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-20110105761-A1 Salts Comprising Aryl-Alkyl-Substituted Imidazolium and Triazolium Cations and the Use Thereof RDX, HAX1, CHRM2 ALDH1A1 2684/4885TAS1R3 483/4885TAS1R1 860/4885

“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.

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