Bromide

Bromide

SCHEMBL21715256

Br.FC1(F)CCN(CCBr)CC1

nearest known ligand 0.38

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 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 known ✓ Q99720 3/20 0.31
HRH3 Q9Y5N1 2/20 0.38
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35

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
SCHEMBL29979002 0.97 HRH3 (0.39) HRH3NOS3NOS1NOS2SIGMAR1
Bromide SCHEMBL20551357 0.86 HRH3 (0.42) HRH3NOS3NOS1NOS2
Bromide SCHEMBL31466403 0.86 CYP3A4 (0.31)
SCHEMBL18091474 0.83 HRH3 (0.44) HRH3NOS3NOS1NOS2SIGMAR1
SCHEMBL29979433 0.76 HRH3 (0.33) HRH3NOS3NOS1NOS2
SCHEMBL29979229 0.75 DRD2 (0.32)
SCHEMBL1255097 0.75 ALOX15 (0.57) HRH3NOS3NOS1NOS2SIGMAR1
SCHEMBL5151766 0.75 KDM4E (0.41) HRH3NOS3NOS1NOS2SIGMAR1
SCHEMBL954044 0.75 HRH3 (0.38) HRH3NOS3NOS1NOS2SIGMAR1
SCHEMBL1473652 0.75 ALDH1A1 (0.43) HRH3NOS3NOS1NOS2

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
CN-110770214-B Heterocyclic P2X7 antagonists 布雷耶疗法有限公司 2024-03-29 CN disclosed
US-11623919-B2 Heterocyclic P2X7 antagonists BREYE THERAPEUTICS APS (DK) 2023-04-11 US disclosed
US-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS BREYE THERAPEUTICS APS (DK) 2020-02-20 US disclosed
CN-110770214-A Heterocyclic P2X7 antagonists 阿克萨姆股份公司 2020-02-07 CN 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 (2 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-20200055831-A1 HETEROCYCLIC P2X7 ANTAGONISTS P2RY1, P2RX1, P2RX3 SIGMAR1 138/4885HRH3 20/4885NOS3 2623/4885
US-11623919-B2 Heterocyclic P2X7 antagonists P2RY1, P2RX1, P2RX3 SIGMAR1 138/4885HRH3 20/4885NOS3 2623/4885

“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.