Bromide

Bromide

SCHEMBL29601604

Br.O=C(O)c1ccnc(Nc2nc(-c3ccccn3)cs2)c1

nearest known ligand 0.71

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
CSNK2A2 P19784 1/20 0.71
CSNK2B P67870 1/20 0.71
SLC2A1 P11166 3/20 0.67
CSNK2A1 P68400 1/20 0.67
KCNN1 Q92952 2/20 0.65
KCNN2 Q9H2S1 2/20 0.65
KCNN3 Q9UGI6 2/20 0.65
MBD2 Q9UBB5 2/20 0.64
MECP2 P51608 1/20 0.64
KDM4A O75164 3/20 0.61
KDM4B O94953 2/20 0.61
KDM5B Q9UGL1 2/20 0.61
KDM5C P41229 2/20 0.61
ADORA3 P0DMS8 3/20 0.59
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
MAPT P10636 2/20 0.57
NFKB1 P19838 2/20 0.57
PPP1CA P62136 2/20 0.57

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
SCHEMBL29078754 0.99 CSNK2A2 (0.73) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL29601353 0.99 CSNK2A2 (0.73) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL24358066 0.88 KCNN1 (0.65) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL30518671 0.88 KCNN1 (0.65) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL24358259 0.85 KCNN1 (0.58) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL30745673 0.85 KCNN1 (0.58) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL24358136 0.84 KCNN1 (0.64) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL29601651 0.84 KCNN1 (0.64) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL27039795 0.84 KCNN1 (0.62) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1
SCHEMBL24358274 0.83 KCNN1 (0.56) CSNK2A2CSNK2BSLC2A1CSNK2A1KCNN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240025891-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CELGENE CORPORATION 2024-01-25 US disclosed
EP-4232449-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES Celgene Corporation (US) 2023-08-30 EP disclosed
CN-116547282-A Heterocyclic compounds and their use for the treatment of helminth infections and diseases 新基公司 2023-08-04 CN disclosed
WO-2022087326-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CELGENE CORPORATION (US) 2022-04-28 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-20240025891-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE FOR TREATMENT OF HELMINTHIC INFECTIONS AND DISEASES CYP8B1, PAH, INHA CSNK2A2 2270/4885CSNK2B 1709/4885SLC2A1 3987/4885

“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.