Bromide

Bromide

SCHEMBL5486542

Br.CC(C)(C)c1cc(CN2CCN(CC(=O)O)CC2)cc(C(=O)CN2Cc3ccc(C4CC4)nc3C2=N)c1

nearest known ligand 0.36

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
ACHE known ✓ P22303 1/20 0.31
F2R P25116 2/20 0.36
TEK Q02763 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ABL1 P00519 1/20 0.32
BCR P11274 1/20 0.32
DDR1 Q08345 1/20 0.32
DDR2 Q16832 1/20 0.32
ALDH1A1 P00352 1/20 0.31
SCN9A Q15858 1/20 0.31
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
DRD2 P14416 1/20 0.31
DRD4 P21917 1/20 0.31
MAOB P27338 1/20 0.31
BCHE P06276 1/20 0.31
MAOA P21397 1/20 0.31

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
Bromide SCHEMBL1730432 0.90 FURIN (0.33) F2RTEKMEN1KMT2AMAOB
Bromide SCHEMBL1731986 0.90 F2R (0.32) F2R
Bromide SCHEMBL5494507 0.87 F2R (0.38) F2RTEKMEN1KMT2AABL1
Bromide SCHEMBL5484838 0.82 MAPT (0.41) F2RMEN1KMT2AABL1BCR
Bromide SCHEMBL1730548 0.82 KDM4E (0.32) F2RKDM4EMAPTRAB9ASMN1; SMN2
Bromide SCHEMBL1730633 0.81 ACHE (0.40) F2RKMT2AALDH1A1KDM4EMAPT
Bromide SCHEMBL1732137 0.79 F2R (0.33) F2R
Bromide SCHEMBL1729985 0.78 RAB9A (0.31) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL14449091 0.78 F2R (0.41) F2RMEN1KMT2AKDM4EMAPT
Bromide SCHEMBL1731717 0.78 F2R (0.31) F2RMEN1KMT2ADDR1

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-7244730-B2 2-iminopyrrolidine derivatives EISAI CO., LTD (JP) 2007-07-17 US disclosed
US-20050245592-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-11-03 US disclosed
US-20050004204-A1 2-Iminopyrrolidine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-06 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 (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-20050245592-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 ACHE 2759/4885F2R 2290/4885TEK 4035/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 ACHE 2748/4885F2R 2289/4885TEK 4034/4885

“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.