Bromide

Bromide

SCHEMBL4362353

Br.CCN(CC)C1=NC(=O)C(=Cc2ccccc2)S1

nearest known ligand 0.69

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
POLB P06746 1/20 0.69
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
NPC1 O15118 1/20 0.54
TNNI3 P19429 1/20 0.54
TNNT2 P45379 1/20 0.54
RAB9A P51151 1/20 0.54
GFER P55789 1/20 0.54
TNNC1 P63316 1/20 0.54
ALOX5 P09917 5/20 0.50
ALDH1A1 P00352 2/20 0.47
MYC P01106 1/20 0.44
MAX P61244 1/20 0.44
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PIM1 P11309 1/20 0.40
PIM3 Q86V86 1/20 0.40
PIM2 Q9P1W9 1/20 0.40

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 SCHEMBL4362351 1.00 POLB (0.69) POLBMEN1KMT2ANPC1TNNI3
SCHEMBL4350154 0.99 POLB (0.71) POLBMEN1KMT2ANPC1TNNI3
SCHEMBL4350157 0.99 POLB (0.71) POLBMEN1KMT2ANPC1TNNI3
SCHEMBL4356501 0.91 POLB (0.60) POLBMEN1KMT2ANPC1TNNI3
SCHEMBL4356499 0.91 POLB (0.60) POLBMEN1KMT2ANPC1TNNI3
Bromide SCHEMBL4348013 0.87 RAB9A (0.56) POLBMEN1KMT2ANPC1TNNI3
Bromide SCHEMBL4348012 0.87 RAB9A (0.56) POLBMEN1KMT2ANPC1TNNI3
Bromide SCHEMBL4357393 0.86 MEN1 (0.55) POLBMEN1KMT2ANPC1TNNI3
Bromide SCHEMBL4357396 0.86 MEN1 (0.55) POLBMEN1KMT2ANPC1TNNI3
SCHEMBL4348545 0.86 RAB9A (0.58) POLBMEN1KMT2ANPC1TNNI3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 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-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs ABCB1, ABCG2, SLC5A2 POLB 4427/4885MEN1 1725/4885KMT2A 3923/4885

“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.