Bromide

Bromide

SCHEMBL2769571

CCN(CC[n+]1ccccc1)c1ccc(N=Nc2nc(C)c(C)s2)cc1.[Br-]

nearest known ligand 0.38

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
INSR P06213 3/20 0.38
MAPT P10636 6/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
KMT2A Q03164 3/20 0.36
PSMD14 O00487 1/20 0.36
MITF O75030 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 3/20 0.32
APP P05067 1/20 0.32
MAPK1 P28482 2/20 0.32
ALPL P05186 1/20 0.31
ALPI P09923 1/20 0.31
ALPG P10696 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31

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 SCHEMBL2771290 1.00 INSR (0.38) INSRMAPTNPC1RAB9AKMT2A
SCHEMBL2770406 0.99 INSR (0.39) INSRMAPTNPC1RAB9AKMT2A
SCHEMBL2770403 0.99 INSR (0.39) INSRMAPTNPC1RAB9AKMT2A
Bromide SCHEMBL2769850 0.83 MAPT (0.37) INSRMAPTNPC1RAB9AKMT2A
Bromide SCHEMBL2769849 0.83 MAPT (0.37) INSRMAPTNPC1RAB9AKMT2A
Bromide SCHEMBL2772249 0.83 MAPT (0.37) INSRMAPTNPC1RAB9AKMT2A
Bromide SCHEMBL2770574 0.83 MAPT (0.37) INSRMAPTNPC1RAB9AKMT2A
SCHEMBL2770692 0.82 MAPT (0.38) INSRMAPTNPC1RAB9AKMT2A
SCHEMBL2770693 0.82 MAPT (0.38) INSRMAPTNPC1RAB9AKMT2A
SCHEMBL2768989 0.82 MAPT (0.40) INSRMAPTNPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1825883-B1 Agents for coloring keratin fibers PROCTER & GAMBLE (US) 2010-04-14 EP claimed
US-7658770-B2 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY (US) 2010-02-09 US claimed
US-20090165221-A1 Agents for Coloring Keratin Fibers WELLA OPERATIONS US, LLC 2009-07-02 US claimed
US-7513916-B2 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY (US) 2009-04-07 US claimed
US-20070199160-A1 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY 2007-08-30 US claimed
EP-1825883-A1 Agents for coloring keratin fibers Wella Aktiengesellschaft (DE) 2007-08-29 EP claimed
EP-1820537-A1 Agents for coloring keratin fibers Wella Aktiengesellschaft (DE) 2007-08-22 EP claimed
US-7658770-B2 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY (US) 2010-02-09 US disclosed
US-20090165221-A1 Agents for Coloring Keratin Fibers WELLA OPERATIONS US, LLC 2009-07-02 US disclosed
US-7513916-B2 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY (US) 2009-04-07 US disclosed
US-20070199160-A1 Agents for coloring keratin fibers THE PROCTER & GAMBLE COMPANY 2007-08-30 US disclosed
WO-2007097930-A1 AGENTS FOR COLORING KERATIN FIBERS THE PROCTER & GAMBLE COMPANY (US) 2007-08-30 WO 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-20090165221-A1 Agents for Coloring Keratin Fibers KRT18, IK, KRTCAP2 INSR 4091/4885MAPT 781/4885NPC1 4249/4885
US-20070199160-A1 Agents for coloring keratin fibers KRT18, IK, KRTCAP2 INSR 4091/4885MAPT 781/4885NPC1 4249/4885

“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.