Bromide

Bromide

SCHEMBL3300229

Br.COc1ccc2nc(-c3ccc(O)cc3)cn2c1

nearest known ligand 0.68

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
ALDH1A3 P47895 6/20 0.68
APP P05067 2/20 0.68
KDM4E B2RXH2 9/20 0.57
RAB9A P51151 9/20 0.57
NPC1 O15118 9/20 0.57
PKM P14618 3/20 0.57
EPHX2 P34913 1/20 0.57
ALDH1A1 P00352 6/20 0.56
POLB P06746 2/20 0.56
GAA P10253 1/20 0.56
GFER P55789 2/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
HPGD P15428 4/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
RCE1 Q9Y256 1/20 0.56
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
MITF O75030 1/20 0.51

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
SCHEMBL2817276 0.98 ALDH1A3 (0.70) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL31380867 0.90 ALDH1A3 (0.86) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL13325701 0.86 ALDH1A3 (0.74) ALDH1A3APPKDM4ERAB9ANPC1
Bromide SCHEMBL2901637 0.85 ALDH1A3 (0.68) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL2906109 0.84 ALDH1A3 (0.70) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL10527726 0.84 ALDH1A3 (0.70) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL2899627 0.84 ALDH1A3 (0.70) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL28338009 0.83 ALDH1A3 (0.81) ALDH1A3APPKDM4ERAB9ANPC1
SCHEMBL12903849 0.81 APP (1.00) ALDH1A3APPTLR9TLR7
SCHEMBL2257095 0.81 APP (0.73) ALDH1A3APPKDM4ERAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042501-B1 COMPOUND HAVING AFFINITY FOR AMYLOID NIHON MEDIPHYSICS CO LTD (JP) 2017-04-12 EP disclosed
US-8277777-B2 Compound having affinity for amyloid NIHON MEDI-PHYSICS CO., LTD. (JP) 2012-10-02 US disclosed
US-20100092387-A1 Novel Compound Having Affinity For Amyloid NIHON MEDI-PHYSICS CO., LTD. (JP) 2010-04-15 US disclosed
EP-2042501-A1 NOVEL COMPOUND HAVING AFFINITY FOR AMYLOID NIHON MEDI-PHYSICS CO., LTD. (JP) 2009-04-01 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-20100092387-A1 Novel Compound Having Affinity For Amyloid APP, SLC43A1, APBA1 ALDH1A3 3784/4885APP 1/4885KDM4E 4283/4885

“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.