Bromide

Bromide

SCHEMBL7224428

Br.CCOC(=O)CCCc1cccc([Zn])c1

nearest known ligand 0.53

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 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.53
PPARA Q07869 3/20 0.49
PPARG P37231 2/20 0.49
CYP4F2 P78329 4/20 0.48
CYP4A11 Q02928 4/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP4Z1 Q86W10 2/20 0.46
CYP4F11 Q9HBI6 1/20 0.46
CYP4F12 Q9HCS2 1/20 0.46
POLB P06746 1/20 0.42
MAPK1 P28482 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
Hydrochloric Acid SCHEMBL7784074 0.97 ALOX5 (0.53) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL765924 0.84 ALOX5 (0.57) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL19089791 0.84 ALOX5 (0.57) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL3906464 0.82 ALOX5 (0.56) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL6294282 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL19899012 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL1068777 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL11588395 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL19078963 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11
SCHEMBL642197 0.81 ALOX5 (0.54) ALOX5PPARAPPARGCYP4F2CYP4A11

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
US-6593480-B2 Obesity, hyperglycemia ABBOTT LABORATORIES 2003-07-15 US disclosed
WO-2002070507-A2 GLYCORTICOID RECEPTOR ANTAGONISTS FOR TREATMENT OF DIABETES ABBOTT LABORATORIES (US) 2002-09-12 WO disclosed
US-20010041802-A1 Glucocorticoid receptor antagonists for treatment of diabetes KARO BIO AB (SE) 2001-11-15 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-20010041802-A1 Glucocorticoid receptor antagonists for treatment of diabetes NR3C1, GPR119, NR3C2 ALOX5 532/4885PPARA 203/4885PPARG 49/4885

“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.