Bromide

Bromide

SCHEMBL29460100

Br.COC(=O)COc1ccc(CC(C)NCC(O)c2cccc(Cl)c2)cc1

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 14)

geneUniProtsupporting neighboursconfidence
ADRB3 known ✓ P13945 14/20 0.98
ADRB2 known ✓ P07550 11/20 0.98
ADRB1 known ✓ P08588 8/20 0.98
ADRA1D known ✓ P25100 1/20 0.81
ADRA1A known ✓ P35348 1/20 0.81
ADRA1B known ✓ P35368 1/20 0.81
GLA P06280 1/20 0.98
CYP2D6 P10635 2/20 0.81
CYP1A2 P05177 1/20 0.81
CYP2C9 P11712 1/20 0.81
CYP2C19 P33261 1/20 0.81
CYP3A4 P08684 1/20 0.79
HIF1A Q16665 1/20 0.79
SLC2A1 P11166 4/20 0.71

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 SCHEMBL9317314 1.00 ADRB3 (0.98) ADRB3ADRB2ADRB1GLACYP2D6
Bromide SCHEMBL9799484 1.00 ADRB3 (0.98) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL5144153 0.99 ADRB3 (1.00) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL4611391 0.99 ADRB3 (1.00) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL5144149 0.99 ADRB3 (1.00) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL9006835 0.99 ADRB3 (1.00) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL5144151 0.99 ADRB3 (1.00) ADRB3ADRB2ADRB1GLACYP2D6
Trifluoroacetic Acid SCHEMBL9318455 0.93 ADRB3 (0.89) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL9812024 0.90 ADRB3 (0.84) ADRB3ADRB2ADRB1GLACYP2D6
SCHEMBL9812022 0.90 ADRB3 (0.84) ADRB3ADRB2ADRB1GLACYP2D6

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4199925-B1 CYCLOPENTAPYRROLE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-05-20 EP disclosed
EP-3558298-B1 ANTIDIABETIC SPIROCHROMAN COMPOUNDS MERCK SHARP & DOHME LLC (US) 2026-03-11 EP disclosed
US-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2026-02-17 US disclosed
EP-4262788-B1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-21 EP disclosed
EP-3924058-B1 5-ALKYL PYRROLIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-07 EP disclosed
US-12497362-B2 Cyclopentapyrrole orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2025-12-16 US disclosed
US-20250346646-A1 COMPOUNDS USEFUL TO TREAT METABOLIC DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2025-11-13 US disclosed
US-20250282760-A1 OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2025-09-11 US disclosed
EP-2958562-B1 ANTIDIABETIC BICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC (US) 2025-09-10 EP disclosed
US-12331018-B2 Pyrrolidine orexin receptor agonists MERCK SHARP & DOHME LLC (US) 2025-06-17 US disclosed
US-20230018413-A1 HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2023-01-19 US disclosed
US-20220411490-A1 METHOD TO IDENTIFY COMPOUNDS USEFUL TO TREAT DYSREGULATED LIPOGENESIS, DIABETES, AND RELATED DISORDERS PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2022-12-29 US disclosed
US-20220354848-A9 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE TES PHARMA S.R.L. (IT) 2022-11-10 US disclosed
CN-109642908-B Compounds useful for treating metabolic disorders 哈佛学院院长及董事 2022-08-16 CN disclosed
US-11401266-B2 Process for the preparation of an orexin receptor antagonist Merck Sharp & Dohme (UK) Ltd. (GB) 2022-08-02 US disclosed
US-11345748-B2 Method of treating idiopathic pulmonary fibrosis and kidney fibrosis PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-05-31 US disclosed
US-20220144771-A1 PYRROLIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-05-12 US disclosed
US-11319346-B2 Ultra-pure agonists of guanylate cyclase C, method of making and using same BAUSCH HEALTH IRELAND LIMITED (IE) 2022-05-03 US disclosed
US-20220119449-A1 ULTRA-PURE AGONISTS OF GUANYLATE CYCLASE C, METHOD OF MAKING AND USING SAME BAUSCH HEALTH IRELAND LIMITED (IE) 2022-04-21 US disclosed
US-20220056017-A1 BICYCLOHEPTANE PYRROLIDINE OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-02-24 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 (13 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-12497362-B2 Cyclopentapyrrole orexin receptor agonists HCRTR2, HCRTR1, NPY1R ADRB3 313/4885ADRB2 372/4885ADRB1 303/4885
US-20220354848-A9 INHIBITORS OF ALPHA-AMINO-BETA-CARBOXYMUCONIC ACID SEMIALDEHYDE DECARBOXYLASE ACMSD, GLS, ALDH7A1 ADRB3 2601/4885ADRB2 2300/4885ADRB1 1154/4885
US-11401266-B2 Process for the preparation of an orexin receptor antagonist HCRTR2, HCRTR1, CRHR1 ADRB3 354/4885ADRB2 244/4885ADRB1 235/4885
US-12552767-B2 3-heteroaryl pyrrolidine and piperidine orexin receptor agonists HCRTR2, HCRTR1, NPY1R ADRB3 131/4885ADRB2 177/4885ADRB1 161/4885
US-20220119449-A1 ULTRA-PURE AGONISTS OF GUANYLATE CYCLASE C, METHOD OF MAKING AND USING SAME GUCY1A1, GUCY1A2, GUCY1B1 ADRB3 273/4885ADRB2 338/4885ADRB1 142/4885
US-11345748-B2 Method of treating idiopathic pulmonary fibrosis and kidney fibrosis CNR2, FABP1, FABP4 ADRB3 218/4885ADRB2 106/4885ADRB1 126/4885
US-20220056017-A1 BICYCLOHEPTANE PYRROLIDINE OREXIN RECEPTOR AGONISTS HCRTR1, HCRTR2, CRHR1 ADRB3 392/4885ADRB2 352/4885ADRB1 316/4885
US-20250282760-A1 OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR ADRB3 264/4885ADRB2 226/4885ADRB1 186/4885
US-11319346-B2 Ultra-pure agonists of guanylate cyclase C, method of making and using same GUCY1A1, GUCY1A2, GUCY1B1 ADRB3 273/4885ADRB2 338/4885ADRB1 142/4885
US-12331018-B2 Pyrrolidine orexin receptor agonists HCRTR2, HCRTR1, OXTR ADRB3 496/4885ADRB2 465/4885ADRB1 387/4885
US-20230018413-A1 HETEROARYL PYRROLIDINE AND PIPERIDINE OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR ADRB3 276/4885ADRB2 314/4885ADRB1 298/4885
US-20220144771-A1 PYRROLIDINE OREXIN RECEPTOR AGONISTS HCRTR2, HCRTR1, OXTR ADRB3 496/4885ADRB2 465/4885ADRB1 387/4885
US-20220411490-A1 METHOD TO IDENTIFY COMPOUNDS USEFUL TO TREAT DYSREGULATED LIPOGENESIS, DIABETES, AND RELATED DISORDERS FABP4, LIPC, CNR2 ADRB3 425/4885ADRB2 295/4885ADRB1 319/4885

“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.