Bromide

Bromide

SCHEMBL4174809

Br.Br.Br.FC(F)(F)c1cnc(N2CCCN(CCc3ccccc3)CC2)c(Cl)c1

nearest known ligand 0.59

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 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 known ✓ Q99720 1/20 0.52
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
MAPT P10636 3/20 0.56
KDM4E B2RXH2 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
CNR2 P34972 2/20 0.56
LMNA P02545 1/20 0.56
PKM P14618 1/20 0.56
GRM2 Q14416 2/20 0.55
DRD2 P14416 1/20 0.55
DRD4 P21917 1/20 0.55
DRD3 P35462 1/20 0.55
POLB P06746 2/20 0.54
CHRM4 P08173 3/20 0.53
ALDH1A1 P00352 3/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL4166695 0.99 MEN1 (0.60) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL3603158 0.78 SMO (0.67) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL4161276 0.78 MAPT (0.64) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL3211123 0.77 POLB (0.68) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL1728824 0.77 POLB (0.67) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL9105524 0.76 POLB (0.75) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL13930739 0.74 MAPT (0.78) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL5792352 0.73 SMN1; SMN2 (0.54) MEN1KMT2AMAPTSMN1; SMN2CNR2
SCHEMBL14136353 0.73 SMN1; SMN2 (0.70) MEN1KMT2AMAPTSMN1; SMN2LMNA
SCHEMBL3075661 0.72 CNR2 (0.67) MEN1KMT2AMAPTSMN1; SMN2CNR2

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-20090018118-A1 HETEROCYCLIC COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2009-01-15 US disclosed
EP-1981849-A1 HETEROCYCLIC COMPOUNDS LEK Pharmaceuticals D.D. (SI) 2008-10-22 EP disclosed
WO-2007073935-A1 HETEROCYCLIC COMPOUNDS LEK PHARMACEUTICALS D.D. (SI) 2007-07-05 WO 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-20090018118-A1 HETEROCYCLIC COMPOUNDS CYP51A1, DHCR7, LSS SIGMAR1 1948/4885MEN1 1408/4885KMT2A 3558/4885

“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.