Bromide

Bromide

SCHEMBL1731874

Br.CCOc1cc2c(c(F)c1OCC)C(=N)N(CC(=O)c1ccc(N3CCCC3)c(C(C)(C)C)c1)C2

nearest known ligand 0.70

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 17)

geneUniProtsupporting neighboursconfidence
F2R P25116 7/20 0.70
RARA P10276 3/20 0.37
RARB P10826 3/20 0.37
RARG P13631 3/20 0.37
TAAR1 Q96RJ0 1/20 0.37
MAPT P10636 6/20 0.37
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 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
Bromide SCHEMBL1730235 0.89 F2R (0.87) F2RMAPTGAASMN1; SMN2
SCHEMBL14449152 0.88 F2R (0.87) F2RMAPTGAASMN1; SMN2
Bromide SCHEMBL1730193 0.88 F2R (0.66) F2RMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL13144389 0.88 F2R (0.86) F2RMAPTGAASMN1; SMN2
Bromide SCHEMBL1732147 0.88 F2R (0.62) F2RMAPTALDH1A1HPGDRAB9A
Bromide SCHEMBL6362254 0.87 F2R (0.75) F2RRARARARBRARGMAPT
SCHEMBL1729286 0.87 F2R (0.65) F2RMAPTRAB9ANPC1SMN1; SMN2
Bromide SCHEMBL1730529 0.86 F2R (0.64) F2RMAPTALDH1A1RAB9ANPC1
Bromide SCHEMBL1732000 0.85 F2R (0.64) F2RMAPTRAB9ANPC1SMN1; SMN2
SCHEMBL6544433 0.85 F2R (0.64) F2RMAPTALDH1A1RAB9ANPC1

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 F2R 2290/4885RARA 2536/4885RARB 2657/4885
US-20050004204-A1 2-Iminopyrrolidine derivatives H1-2, H1-3, H1-0 F2R 2289/4885RARA 2540/4885RARB 2647/4885

“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.