Bromide

Bromide

SCHEMBL4256896

Br.NC(=O)c1oc2c(O)cccc2c1N

nearest known ligand 0.43

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 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAOA P21397 6/20 0.42
EGFR P00533 1/20 0.42
LCK P06239 1/20 0.42
ATP1A1 P05023 2/20 0.41
ATP1B1 P05026 2/20 0.41
ATP1A3 P13637 2/20 0.41
ATP1B2 P14415 2/20 0.41
ATP1A2 P50993 2/20 0.41
ATP1B3 P54709 2/20 0.41
FXYD2 P54710 2/20 0.41
ATP1A4 Q13733 2/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
MAPT P10636 2/20 0.37
NPC1 O15118 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL13699670 0.80 MCL1 (0.57) KDM4EALDH1A1HPGDHSD17B10LCK
Ammonia Solution, Strong SCHEMBL4256892 0.79 MAOA (0.41) KDM4EALDH1A1HPGDHSD17B10MAOA
SCHEMBL4251368 0.76 ALDH1A1 (0.51) KDM4EALDH1A1HPGDHSD17B10MAOA
SCHEMBL28290291 0.76 MAOA (0.50) MAOAEGFRLCKATP1A1ATP1B1
SCHEMBL13699673 0.75 HPGD (0.55) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL20534983 0.73 MAPT (0.44) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL13699676 0.73 CYP1A2 (0.44) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL1006030 0.72 MAPT (0.67) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL20534839 0.70 KDM4E (0.57) KDM4EALDH1A1HPGDHSD17B10MAPT
SCHEMBL20535444 0.70 KDM4E (0.47) KDM4EALDH1A1HPGDHSD17B10MAPT

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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE KISSEI PHARMACEUTICAL CO., LTD. (JP) 2009-09-24 US disclosed
EP-1710233-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE Kissei Pharmaceutical Co., Ltd. (JP) 2006-10-11 EP 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-20090239860-A1 NOVEL BENZOFURAN DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND USES OF THESE ADORA2A, ADORA2B, HTR1F KDM4E 4227/4885ALDH1A1 559/4885HPGD 3251/4885

“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.