Bromide

Bromide

SCHEMBL5282167

Br.OCC1CNCC(O)C1c1ccc(O)cc1

nearest known ligand 0.46

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 11)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 6/20 0.46
PYGL P06737 1/20 0.46
GBA2 Q9HCG7 1/20 0.46
GAA P10253 1/20 0.46
GLB1 P16278 1/20 0.46
MGAM O43451 1/20 0.38
ESR1 P03372 5/20 0.38
ESR2 Q92731 5/20 0.38
CYP2C9 P11712 3/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 1/20 0.34

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 SCHEMBL1941630 1.00 GBA1 (0.46) GBA1PYGLGBA2GAAGLB1
SCHEMBL6958961 0.98 GBA1 (0.47) GBA1PYGLGBA2GAAGLB1
SCHEMBL2684014 0.98 GBA1 (0.47) GBA1PYGLGBA2GAAGLB1
SCHEMBL6042903 0.84 GBA1 (0.46) GBA1PYGLGBA2GAAGLB1
SCHEMBL6041817 0.82 ESR2 (0.42) GBA1GAAGLB1MGAMESR1
SCHEMBL6041814 0.82 ESR2 (0.42) GBA1GAAGLB1MGAMESR1
SCHEMBL6955872 0.80 GBA1 (0.43) GBA1PYGLGBA2GAAGLB1
SCHEMBL6042465 0.76 KDM4E (0.42) GBA1PYGLGBA2GAAGLB1
SCHEMBL6626149 0.71 REN (0.42) GBA1ESR1ESR2CYP2C9
SCHEMBL12558167 0.70 ESR2 (0.37) GBA1GAAMGAMESR1ESR2

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
EP-1863763-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS Speedel Experimenta AG (CH) 2007-12-12 EP disclosed
WO-2006103275-A1 3,4,5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2006-10-05 WO disclosed
US-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 GBA1 158/4885PYGL 1530/4885GBA2 324/4885

“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.