Bromide

Bromide

SCHEMBL3939438

COc1cccc(C[Zn+])c1.[Br-]

nearest known ligand 0.58

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
CHRM2 known ✓ P08172 3/20 0.55
CHRM1 known ✓ P11229 2/20 0.55
CHRM3 known ✓ P20309 2/20 0.55
TAAR1 Q96RJ0 3/20 0.58
IDO1 P14902 2/20 0.58
AGXT P21549 2/20 0.58
CMA1 P23946 1/20 0.53
MAOB P27338 2/20 0.52
SIGMAR1 Q99720 2/20 0.51
AOC3 Q16853 1/20 0.51
ALDH1A1 P00352 1/20 0.51
LPO P22079 1/20 0.50

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
Hydrochloric Acid SCHEMBL1792278 0.96 TAAR1 (0.58) TAAR1IDO1AGXTCHRM2CHRM1
Pivalate SCHEMBL9953503 0.82 CYP1A2 (0.48) TAAR1IDO1AGXTCMA1ALDH1A1
SCHEMBL4551035 0.81 TAAR1 (0.60) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL2099512 0.80 CHRM2 (0.66) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL30080050 0.80 TAAR1 (0.77) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL723511 0.80 TAAR1 (0.77) TAAR1IDO1AGXTCHRM2CHRM1
Bromide SCHEMBL27455440 0.79 TAAR1 (0.58) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL1975466 0.79 TAAR1 (0.69) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL29908907 0.78 TAAR1 (0.62) TAAR1IDO1AGXTCHRM2CHRM1
SCHEMBL12497 0.78 TAAR1 (0.62) TAAR1IDO1AGXTCHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109153646-B Pyridine dicarboxamide derivatives as bromodomain inhibitors 葛兰素史克知识产权第二有限公司 2022-08-02 CN disclosed
US-10934272-B2 Pyridyl derivatives as bromodomain inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2021-03-02 US disclosed
US-10844015-B2 Pyridine dicarboxamide derivatives as bromodomain inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2020-11-24 US disclosed
EP-3440069-B1 PYRIDYL DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2020-10-28 EP disclosed
US-20200207741-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE HOFFMANN-LA ROCHE INC. 2020-07-02 US disclosed
US-10640491-B2 Inhibitors of bruton's tyrosine kinase HOFFMANN-LA ROCHE INC. (US) 2020-05-05 US disclosed
US-20190202786-A1 PYRIDINE DICARBOXAMIDE DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2019-07-04 US disclosed
US-20190119248-A1 PYRIDYL DERIVATIVES AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2019-04-25 US disclosed
EP-3464242-A1 PYRIDINE DICARBOXAMIDE DERIVATIVES AS BROMODOMAIN INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2019-04-10 EP disclosed
EP-3440069-A1 PYRIDYL DERIVATIVES AS BROMODOMAIN INHIBITORS GlaxoSmithKline Intellectual Property (No. 2) Limited (GB) 2019-02-13 EP disclosed
WO-2013164292-A1 INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-11-07 WO disclosed
US-20130289074-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-31 US disclosed
CN-103380117-A Picolinamide inhibitors of kinases ABBOTT LAB 2013-10-30 CN disclosed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 WO disclosed
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 US disclosed
EP-2044061-A2 BENZOTHIOPHENE INHIBITORS OF RHO KINASE Kahraman, Mehmet (US) 2009-04-08 EP disclosed
WO-2008011560-A2 BENZOTHIOPHENE INHIBITORS OF RHO KINASE KAHRAMAN MEHMET (US) 2008-01-24 WO disclosed
US-20080021026-A1 BENZOTHIOPHENE INHIBITORS OF RHO KINASE Kahraman, Mehmet (US) 2008-01-24 US disclosed
US-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases ARENA PHARMACEUTICALS, INC. (US) 2008-01-10 US disclosed
WO-2005042491-A1 BENZAZEPINE DERIVATIVES AND METHODS OF PROPHYLAXIS OR TREATMENT OF 5HT2C RECEPTOR ASSOCIATED DISEASES ARENA PHARMACEUTICALS, INC. (US) 2005-05-12 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 (10 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-20080021026-A1 BENZOTHIOPHENE INHIBITORS OF RHO KINASE RHOT2, ROCK2, ROCK1 CHRM2 4015/4885CHRM1 3769/4885CHRM3 2590/4885
US-20080009478-A1 Benzazepine Derivatives and Methods of Prophylaxis or Treatment of 5Ht2c Receptor Associated Diseases HTR2C, HTR2A, HTR2B CHRM2 631/4885CHRM1 709/4885CHRM3 339/4885
US-10934272-B2 Pyridyl derivatives as bromodomain inhibitors BRD4, BRD3, BRDT CHRM2 1532/4885CHRM1 1948/4885CHRM3 982/4885
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ALK, PKN2, ERBB2 CHRM2 3092/4885CHRM1 3445/4885CHRM3 3486/4885
US-20190119248-A1 PYRIDYL DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRDT CHRM2 1532/4885CHRM1 1948/4885CHRM3 982/4885
US-20200207741-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE BTK, SYK, LYN CHRM2 4100/4885CHRM1 3858/4885CHRM3 4142/4885
US-10640491-B2 Inhibitors of bruton's tyrosine kinase BTK, SYK, LYN CHRM2 4373/4885CHRM1 4217/4885CHRM3 4325/4885
US-20130289074-A1 NEW INDANYLOXYDIHYDROBENZOFURANYLACETIC ACIDS GPR119, GPR55, GPR52 CHRM2 83/4885CHRM1 99/4885CHRM3 368/4885
US-20190202786-A1 PYRIDINE DICARBOXAMIDE DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRPF3 CHRM2 1155/4885CHRM1 1557/4885CHRM3 702/4885
US-10844015-B2 Pyridine dicarboxamide derivatives as bromodomain inhibitors BRD4, BRD3, BRPF3 CHRM2 1155/4885CHRM1 1557/4885CHRM3 702/4885

“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.