Bromide

Bromide

SCHEMBL1977149

C[n+]1ccn(CCCCCCCCCCC(=O)O)c1.[Br-]

nearest known ligand 0.63

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 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.63
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
HSP90AA1 P07900 2/20 0.63
APAF1 O14727 1/20 0.63
NPC1 O15118 1/20 0.63
PLA2G1B P04054 1/20 0.63
MAPT P10636 1/20 0.63
MAPK1 P28482 1/20 0.63
HTT P42858 1/20 0.63
RAB9A P51151 1/20 0.63
NPSR1 Q6W5P4 1/20 0.63
ATG4B Q9Y4P1 1/20 0.63
TBXAS1 P24557 3/20 0.47
LMNA P02545 2/20 0.41
PTGS1 P23219 4/20 0.40
PTGS2 P35354 4/20 0.40
TSHR P16473 3/20 0.39
NFKB1 P19838 1/20 0.39
PMP22 Q01453 1/20 0.39

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 SCHEMBL6114995 1.00 SMN1; SMN2 (0.63) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Glutarate SCHEMBL29142253 0.91 MEN1 (0.74) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Glutarate SCHEMBL29142331 0.88 SMN1; SMN2 (0.64) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Bromide SCHEMBL571258 0.86 SMN1; SMN2 (0.51) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
SCHEMBL28513046 0.86 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
SCHEMBL717073 0.84 SMN1; SMN2 (0.49) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Glutarate SCHEMBL29142297 0.84 MEN1 (0.64) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Bromide SCHEMBL29479433 0.84 SMN1; SMN2 (0.85) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Bromide SCHEMBL18834186 0.84 SMN1; SMN2 (0.85) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1
Bromide SCHEMBL17395315 0.84 SMN1; SMN2 (0.85) SMN1; SMN2MEN1KMT2AHSP90AA1APAF1

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-8541591-B2 Nanoparticle/dispersant complex, nanoparticle dispersion liquid, and nanoparticle/matrix-material complex CANON KABUSHIKI KAISHA (JP) 2013-09-24 US disclosed
US-20110144061-A1 NANOPARTICLE/DISPERSANT COMPLEX, NANOPARTICLE DISPERSION LIQUID, AND NANOPARTICLE/MATRIX-MATERIAL COMPLEX CANON KABUSHIKI KAISHA (JP) 2011-06-16 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-20110144061-A1 NANOPARTICLE/DISPERSANT COMPLEX, NANOPARTICLE DISPERSION LIQUID, AND NANOPARTICLE/MATRIX-MATERIAL COMPLEX RAB5IF, ORMDL3, SLC6A11 SMN1; SMN2 1413/4885MEN1 433/4885KMT2A 4220/4885

“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.