Bromide

Bromide

SCHEMBL19469280

CCOC(=O)C[n+]1ccc(/C=C/c2ccc(N(CC)CC)cc2)cc1.[Br-]

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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
CHRM2 known ✓ P08172 2/20 0.53
CHRM4 known ✓ P08173 2/20 0.53
CHRM5 known ✓ P08912 2/20 0.53
CHRM1 known ✓ P11229 2/20 0.53
CHRM3 known ✓ P20309 2/20 0.53
ACHE known ✓ P22303 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.45
ALDH1A1 P00352 9/20 0.44
ALDH3A1 P30838 1/20 0.44
ALDH1A3 P47895 1/20 0.44
MAPT P10636 6/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
POLB P06746 3/20 0.43
MAPK1 P28482 2/20 0.43
RECQL P46063 2/20 0.43
TLR9 Q9NR96 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
USP2 O75604 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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 SCHEMBL19469275 1.00 CHRM2 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL29930859 0.99 CHRM2 (0.51) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19506334 0.99 CHRM2 (0.51) CHRM2CHRM4CHRM5CHRM1CHRM3
Bromide SCHEMBL5279859 0.86 CA12 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
Bromide SCHEMBL8848908 0.86 CA12 (0.41) CHRM2CHRM4CHRM5CHRM1CHRM3
Bromide SCHEMBL28793443 0.84 AOC3 (0.46) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19506338 0.83 CHRM2 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL19519178 0.83 CHRM2 (0.54) CHRM2CHRM4CHRM5CHRM1CHRM3
Hydrochloric Acid SCHEMBL19469279 0.82 CHRM2 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3
Hydrochloric Acid SCHEMBL19469278 0.82 CHRM2 (0.53) CHRM2CHRM4CHRM5CHRM1CHRM3

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
US-10842846-B2 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging HONG KONG BAPTIST UNIVERSITY (CN) 2020-11-24 US claimed
EP-3448423-B1 INHIBITOR FOR USE IN TREATING AND IMAGING EBV-ASSOCIATED TUMORS UNIV HONG KONG BAPTIST UNIV (CN) 2023-07-19 EP disclosed
US-10842846-B2 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging HONG KONG BAPTIST UNIVERSITY (CN) 2020-11-24 US disclosed
US-10137115-B2 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging HONG KONG BAPTIST UNIVERSITY (HK) 2018-11-27 US disclosed
US-20170304284-A1 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging HONG KONG BAPTIST UNIVERSITY (HK) 2017-10-26 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 (3 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-10842846-B2 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging EBNA1BP2, BID, TP53 CHRM2 4834/4885CHRM4 4558/4885CHRM5 4803/4885
US-10137115-B2 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging RBBP4, TP53, EBNA1BP2 CHRM2 4152/4885CHRM4 2397/4885CHRM5 4738/4885
US-20170304284-A1 Therapeutic inhibitor for EBV-associated tumor with tailor responsive optical imaging RBBP4, TP53, EBNA1BP2 CHRM2 4152/4885CHRM4 2397/4885CHRM5 4738/4885

“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.