Bromide

Bromide

SCHEMBL1313738

O=C(C[n+]1ccccc1)c1ccc(Cl)cc1.[Br-]

nearest known ligand 0.93

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 18)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 2/20 0.93
KDM4E B2RXH2 3/20 0.70
USP2 O75604 1/20 0.61
KMT2A Q03164 3/20 0.56
MEN1 O00255 2/20 0.56
RAB9A P51151 1/20 0.56
MAPT P10636 3/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
ATM Q13315 2/20 0.51
ALDH1A1 P00352 5/20 0.50
GSK3B P49841 2/20 0.50
LMNA P02545 2/20 0.50
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
ERCC5 P28715 1/20 0.49
FEN1 P39748 1/20 0.49
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL10916379 0.98 PABPC1 (0.96) PABPC1KDM4EUSP2KMT2AMEN1
Bromide SCHEMBL11696481 0.89 PABPC1 (0.74) PABPC1KDM4EUSP2KMT2AMEN1
SCHEMBL26709140 0.87 PABPC1 (0.77) PABPC1KDM4EUSP2KMT2AMEN1
Iodide SCHEMBL11697562 0.85 PABPC1 (0.80) PABPC1KDM4EUSP2KMT2AMEN1
Bromide SCHEMBL27941533 0.85 KDM4E (0.79) PABPC1KDM4EKMT2AMEN1RAB9A
Bromide SCHEMBL698678 0.85 KDM4E (0.79) PABPC1KDM4EKMT2AMEN1RAB9A
SCHEMBL10916383 0.84 PABPC1 (0.72) PABPC1KDM4EUSP2KMT2AMEN1
Bromide SCHEMBL11785962 0.83 USP2 (0.67) PABPC1KDM4EUSP2KMT2AMEN1
SCHEMBL765905 0.83 KDM4E (0.76) PABPC1KDM4EKMT2AMEN1RAB9A
Bromide SCHEMBL8662013 0.82 KDM4E (1.00) PABPC1KDM4EKMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2331541-B1 INDOLIZINE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INT (DE) 2015-04-22 EP disclosed
US-8618300-B2 Indolizine inhibitors of leukotriene production BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-12-31 US disclosed
US-20110275627-A1 INDOLIZINE INHIBITORS OF LEUKOTRIENE PRODUCTION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 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-20110275627-A1 INDOLIZINE INHIBITORS OF LEUKOTRIENE PRODUCTION LTB4R, LTB4R2, LTC4S PABPC1 4789/4885KDM4E 1878/4885USP2 4551/4885

“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.