Bromide

Bromide

SCHEMBL1744987

Br.CCCNc1nc(-c2ccc(C(F)(F)F)cc2)cs1

nearest known ligand 0.54

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
ADRA1A known ✓ P35348 1/20 0.44
ALDH1A1 P00352 3/20 0.54
NPC1 O15118 2/20 0.54
MAPT P10636 2/20 0.54
RAB9A P51151 2/20 0.54
STAT1 P42224 1/20 0.54
ALOX5 P09917 2/20 0.54
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
GSTO1 P78417 1/20 0.52
LMNA P02545 1/20 0.51
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KDM1A O60341 1/20 0.49
TYR P14679 1/20 0.49
LTA4H P09960 1/20 0.49
KDM4E B2RXH2 2/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL1108681 0.99 ALDH1A1 (0.56) ALDH1A1NPC1MAPTRAB9ASTAT1
SCHEMBL1100593 0.84 ALOX5 (0.52) ALDH1A1NPC1MAPTRAB9ASTAT1
Bromide SCHEMBL1746805 0.82 NPC1 (0.76) ALDH1A1NPC1MAPTRAB9ASTAT1
SCHEMBL3911703 0.81 KDM4E (0.74) ALDH1A1NPC1MAPTRAB9ASTAT1
SCHEMBL1747328 0.80 RAB9A (0.81) ALDH1A1NPC1MAPTRAB9ASTAT1
SCHEMBL24590355 0.80 NPC1 (0.64) ALDH1A1NPC1MAPTRAB9AALOX5
SCHEMBL3918661 0.80 GAA (0.58) ALDH1A1NPC1MAPTRAB9AALOX5
SCHEMBL13685439 0.78 RAB9A (0.57) ALDH1A1NPC1MAPTRAB9ASTAT1
SCHEMBL24590319 0.77 ALOX5 (0.59) ALDH1A1NPC1MAPTRAB9AALOX5
SCHEMBL28911485 0.77 ALOX5 (0.62) ALDH1A1MAPTALOX5MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1559422-B1 RECEPTOR FUNCTION CONTROLLING AGENT TAKEDA PHARMACEUTICAL (JP) 2014-04-30 EP disclosed
EP-2385032-A1 GPR40 Receptor function regulator Takeda Pharmaceutical Company Limited (JP) 2011-11-09 EP disclosed
US-7960369-B2 Receptor function regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-06-14 US disclosed
US-20090012093-A1 Receptor Function Regulator TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-01-08 US disclosed
EP-1559422-A1 RECEPTOR FUNCTION CONTROLLING AGENT Takeda Pharmaceutical Company Limited (JP) 2005-08-03 EP 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 (1 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-20090012093-A1 Receptor Function Regulator GPR119, GIPR, INSR ADRA1A 302/4885ALDH1A1 4258/4885NPC1 1470/4885

“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.