Bromide

Bromide

SCHEMBL4352712

Br.CC(C)c1ccc(/C=C2\SC(N3CCOCC3)=NC2=O)cc1

nearest known ligand 0.78

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 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.78
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
MAPT P10636 6/20 0.58
ALDH1A1 P00352 6/20 0.58
CYP1A2 P05177 2/20 0.58
CYP2C19 P33261 2/20 0.58
KDM4E B2RXH2 1/20 0.58
GAA P10253 1/20 0.58
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
NPSR1 Q6W5P4 2/20 0.57
HPGD P15428 1/20 0.57
MAPK1 P28482 1/20 0.55
ENPP2 Q13822 1/20 0.55
NPC1 O15118 3/20 0.54
ALOX5 P09917 1/20 0.54
IDE P14735 1/20 0.54
DCTPP1 Q9H773 1/20 0.53

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 SCHEMBL4352716 1.00 HTT (0.78) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL4364711 0.99 HTT (0.80) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL4364714 0.99 HTT (0.80) HTTMEN1KMT2AMAPTALDH1A1
Bromide SCHEMBL4357470 0.87 MAPT (0.77) HTTMEN1KMT2AMAPTALDH1A1
Bromide SCHEMBL4357476 0.87 MAPT (0.77) HTTMEN1KMT2AMAPTALDH1A1
Bromide SCHEMBL4354216 0.87 ENPP2 (0.67) HTTMEN1KMT2AMAPTALDH1A1
Bromide SCHEMBL4354220 0.87 ENPP2 (0.67) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL15356710 0.86 HTT (0.61) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL4359627 0.86 HTT (0.82) HTTMEN1KMT2AMAPTALDH1A1
SCHEMBL4359625 0.86 HTT (0.82) HTTMEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs GRUENENTHAL GMBH (DE) 2009-08-27 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 (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-20090215758-A1 Use of 2,5-Disubstituted Thiazol-4-One Derivatives in Drugs ABCB1, ABCG2, SLC5A2 HTT 645/4885MEN1 1725/4885KMT2A 3923/4885

“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.