Bromide

Bromide

SCHEMBL3060756

Br.Cn1c(C(=O)N2CCN(Cc3ccc4c(c3)OCO4)CC2)cc2cc(Oc3ccc(NCc4ccc(Cl)c(Cl)c4)cn3)ccc21

nearest known ligand 0.47

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
ADRA2A known ✓ P08913 1/20 0.44
SLC6A2 known ✓ P23975 1/20 0.44
SLC6A4 known ✓ P31645 1/20 0.44
ADRA1A known ✓ P35348 1/20 0.44
SLC6A3 known ✓ Q01959 1/20 0.44
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 4/20 0.44
CYP3A4 P08684 2/20 0.44
ABCB11 O95342 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CHRM1 P11229 1/20 0.44
TBXA2R P21731 1/20 0.44
CYP2C19 P33261 1/20 0.44
OPRM1 P35372 1/20 0.44
DRD3 P35462 1/20 0.44
KCNH2 Q12809 1/20 0.44

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
SCHEMBL10180858 0.99 MEN1 (0.48) MEN1KMT2AUSP2HPGDLMNA
Bromide SCHEMBL3062614 0.90 STAT3 (0.46) STAT3
Bromide SCHEMBL3067318 0.90 MEN1 (0.51) MEN1KMT2AUSP2HPGDLMNA
SCHEMBL3064146 0.89 HPGD (0.51) MEN1KMT2AUSP2HPGDLMNA
SCHEMBL3065452 0.88 HPGD (0.52) MEN1KMT2AUSP2HPGDLMNA
Hydrochloric Acid SCHEMBL3069882 0.88 ALDH1A1 (0.47) MEN1KMT2AUSP2HPGDLMNA
Bromide SCHEMBL3060750 0.87 MEN1 (0.48) MEN1KMT2AUSP2HPGDLMNA
SCHEMBL10180854 0.86 MEN1 (0.49) MEN1KMT2AUSP2HPGDLMNA
SCHEMBL3051195 0.86 USP2 (0.45) MEN1KMT2AUSP2HPGDLMNA
Bromide SCHEMBL3055281 0.85 MEN1 (0.51) MEN1KMT2AUSP2HPGDLMNA

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-8551999-B2 Heterocyclic compound and pharmaceutical composition thereof OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-10-08 US disclosed
US-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-10-14 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-20100261720-A1 HETEROCYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION THEREOF COL1A1, COL2A1, COL14A1 ADRA2A 163/4885SLC6A2 3305/4885SLC6A4 2469/4885

“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.