Bromide

Bromide

SCHEMBL5494483

Br.CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1cc(NCCN3CCOCC3)c(OC)c(C(C)(C)C)c1)C2

nearest known ligand 0.74

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 10)

geneUniProtsupporting neighboursconfidence
F2R P25116 11/20 0.74
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CSF1R P07333 1/20 0.33

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
SCHEMBL1731637 0.99 F2R (0.74) F2RTSHRMEN1KMT2AALDH1A1
Bromide SCHEMBL1731695 0.89 F2R (0.74) F2R
Bromide SCHEMBL1731103 0.89 F2R (0.69) F2RKDM4E
Bromide SCHEMBL1729471 0.88 F2R (0.68) F2RMEN1KMT2AKDM4E
SCHEMBL1732099 0.88 F2R (0.68) F2RKDM4E
Bromide SCHEMBL1731542 0.88 F2R (0.71) F2RKDM4E
Bromide SCHEMBL1732203 0.88 F2R (0.67) F2RKDM4E
Hydrochloric Acid SCHEMBL1730394 0.88 F2R (0.69) F2RKDM4E
Bromide SCHEMBL5487745 0.87 F2R (0.69) F2RKDM4E
Bromide SCHEMBL1731061 0.86 F2R (0.73) F2RKDM4E

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 F2R 2290/4885TSHR 909/4885MEN1 891/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885TSHR 911/4885MEN1 859/4885

“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.