Bromide

Bromide

SCHEMBL4342128

Br.CC(C)(C)c1cc(C(=O)Cn2ccn(CCCCCCO)c2=N)cc(C(C)(C)C)c1O

nearest known ligand 0.52

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
F2R P25116 10/20 0.52
CYP3A4 P08684 1/20 0.42
ALOX5 P09917 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
HSD17B10 Q99714 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
LMNA P02545 1/20 0.36
RECQL P46063 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL14346238 0.99 F2R (0.53) F2RCYP3A4ALOX5PTGS1PTGS2
Bromide SCHEMBL4333484 0.91 F2R (0.62) F2RCYP3A4ALOX5PTGS1PTGS2
SCHEMBL14346229 0.90 F2R (0.64) F2RCYP3A4ALOX5PTGS1PTGS2
Bromide SCHEMBL4341485 0.84 F2R (0.48) F2RCYP3A4ALOX5PTGS1PTGS2
Bromide SCHEMBL4346030 0.83 F2R (0.50) F2RCYP3A4ALOX5PTGS1PTGS2
SCHEMBL14346273 0.82 F2R (0.49) F2RCYP3A4ALOX5PTGS1PTGS2
SCHEMBL14369191 0.82 F2R (0.43) F2RCYP3A4ALOX5PTGS1PTGS2
Bromide SCHEMBL4338956 0.82 F2R (0.49) F2RALOX5PTGS1PTGS2KMT2A
Bromide SCHEMBL4347349 0.82 F2R (0.49) F2RALOX5PTGS1PTGS2KMT2A
SCHEMBL14346262 0.81 F2R (0.51) F2RCYP3A4ALOX5PTGS1PTGS2

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-1391456-B1 2-IMINOIMIDAZOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2009-07-22 EP disclosed
US-7304083-B2 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2007-12-04 US disclosed
US-20050004197-A1 2-iminoimidazole derivatives (2) EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-06 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-20050004197-A1 2-iminoimidazole derivatives (2) H1-2, H1-3, H1-4 F2R 2393/4885CYP3A4 314/4885ALOX5 4372/4885

“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.