Bromide

Bromide

SCHEMBL21874203

[Br-].[Mg+]c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.64

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
▸ LMNA P02545 1/20 0.64
▸ CYP1A2 P05177 1/20 0.64
▸ PTGS1 P23219 1/20 0.64
▸ SLC6A2 P23975 1/20 0.64
▸ CYP2C19 P33261 1/20 0.64
▸ PTGS2 P35354 1/20 0.64
▸ SLC6A3 Q01959 1/20 0.64
▸ HIF1A Q16665 1/20 0.64
▸ HDAC6 Q9UBN7 1/20 0.64
▸ MAOB P27338 4/20 0.62
▸ GAA P10253 1/20 0.62
▸ MAPT P10636 1/20 0.62
▸ MAOA P21397 1/20 0.62
▸ RAB9A P51151 1/20 0.62
▸ SMN1; SMN2 Q16637 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ BCHE P06276 1/20 0.58
▸ NR4A1 P22736 1/20 0.56
▸ NR4A2 P43354 1/20 0.56
▸ NR4A3 Q92570 1/20 0.56

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
SCHEMBL339813 0.87 LMNA (0.82) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL27367676 0.87 LMNA (0.82) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL10609652 0.82 LMNA (0.75) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL61660 0.82 LMNA (0.74) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL12260995 0.81 LMNA (0.67) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9808056 0.80 LMNA (0.72) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL5538712 0.80 LMNA (0.72) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL197017 0.80 LMNA (0.72) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL23235842 0.80 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19
Benzylphenylether SCHEMBL9549322 0.80 LMNA (0.71) LMNACYP1A2PTGS1SLC6A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104803846-B The method for preparing bis- [4- (6- acryloyl-oxy hexyl) phenyl] hexamethylene -1,4- dicarboxylic esters 默克专利股份有限公司 2019-06-11 — — CN claimed
CN-104803846-A Method for the preparation of bis[4-(6-acryloyloxy-hexyl)-phenyl]cyclohexane-1,4-dicarboxylate MERCK PATENT GMBH 2015-07-29 — — CN claimed
US-11274100-B2 EP300/CREBBP inhibitor DAIICHI SANKYO COMPANY, LIMITED (JP) 2022-03-15 — — US disclosed
US-11084842-B2 Glucopyranosyl derivative and use thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-08-10 — — US disclosed
US-20210171520-A1 EP300/CREBBP INHIBITOR DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-06-10 — — US disclosed
US-20210061839-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-03-04 — — US disclosed
CN-112153968-A Process for the preparation of alpha-carboxamide pyrrolidine derivatives 生物基因公司 2020-12-29 — — CN disclosed
CN-107207473-B Compounds having muscarinic receptor antagonist and β 2 adrenergic receptor agonist activity 奇斯药制品公司 2020-07-07 — — CN disclosed
EP-3643703-A1 EP300/CREBBP INHIBITOR Daiichi Sankyo Co., Ltd. (JP) 2020-04-29 — — EP disclosed
CN-110066302-A Glucopyranosyl derivatives and application thereof 广东东阳光药业有限公司 2019-07-30 — — CN disclosed
CN-104803846-B The method for preparing bis- [4- (6- acryloyl-oxy hexyl) phenyl] hexamethylene -1,4- dicarboxylic esters 默克专利股份有限公司 2019-06-11 — — CN disclosed
CN-108698973-A Polymerizable compound and use its liquid-crystal composition DIC株式会社 2018-10-23 — — CN disclosed
CN-106661008-A 2,5-disubstituted cyclopentane carboxylic acids for the treatment of respiratoy tract diseases 拜耳制药股份公司 2017-05-10 — — CN disclosed
CN-106458938-A Chiral 2,5-disubstituted cyclopentanecarboxylic acid derivatives and use thereof 拜耳制药股份公司 2017-02-22 — — CN disclosed
CN-104803846-A Method for the preparation of bis[4-(6-acryloyloxy-hexyl)-phenyl]cyclohexane-1,4-dicarboxylate MERCK PATENT GMBH 2015-07-29 — — CN disclosed
CN-102869667-A Tricyclic pyridine derivatives, medicaments containing these compounds, their use and processes for their preparation BOEHRINGER INGELHEIM INT 2013-01-09 — — CN disclosed
CN-102656145-A Modulators of G-protein coupled receptor 88 BRISTOL MYERS SQUIBB CO 2012-09-05 — — CN disclosed
CN-1950328-A Phenyl indan derivatives LUNDBECK & CO AS H (DK) 2007-04-18 — — CN 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 (4 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-11274100-B2 EP300/CREBBP inhibitor EP300, CREBBP, CREB1 LMNA 3256/4885CYP1A2 4354/4885PTGS1 1593/4885
US-20210061839-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SLC5A1, SLC5A2, UGGT1 LMNA 4427/4885CYP1A2 939/4885PTGS1 1154/4885
US-20210171520-A1 EP300/CREBBP INHIBITOR EP300, CREBBP, CREB1 LMNA 3256/4885CYP1A2 4354/4885PTGS1 1593/4885
US-11084842-B2 Glucopyranosyl derivative and use thereof SLC5A1, SLC5A2, UGGT1 LMNA 4427/4885CYP1A2 939/4885PTGS1 1154/4885

“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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