Bromide

Bromide

SCHEMBL1729145

Br.CC(=O)Nc1ccc2c(c1)CN(CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C2=N

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 0.37
SLC6A2 known ✓ P23975 1/20 0.37
SLC6A4 known ✓ P31645 1/20 0.37
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
RAB9A P51151 3/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
F2R P25116 10/20 0.41
NPC1 O15118 2/20 0.41
HSP90AA1 P07900 1/20 0.37
TLR9 Q9NR96 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAOA P21397 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
BAZ2B Q9UIF8 1/20 0.36
MEN1 O00255 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
Bromide SCHEMBL5488479 0.92 KDM4E (0.44) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1729335 0.92 ALDH1A1 (0.43) ALDH1A1GAATDP1RAB9AKDM4E
Bromide SCHEMBL1730516 0.91 KDM4E (0.41) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1729524 0.87 F2R (0.40) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1730978 0.86 KDM4E (0.46) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL5486176 0.84 KDM4E (0.44) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1728976 0.84 KDM4E (0.45) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL5494303 0.83 KDM4E (0.41) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1729095 0.83 F2R (0.46) RAB9AKDM4EMAPTSMN1; SMN2F2R
Bromide SCHEMBL1731559 0.83 F2R (0.40) RAB9AKDM4EMAPTSMN1; SMN2F2R

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
EP-1391451-B1 2-IMINOPYRROLIDINE DERIVATES EISAI R&D MAN CO LTD (JP) 2011-11-23 EP disclosed
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 ADRA2A 78/4885SLC6A2 1624/4885SLC6A4 1452/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 ADRA2A 81/4885SLC6A2 1634/4885SLC6A4 1461/4885

“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.