Bromide

Bromide

SCHEMBL3845970

Cc1n(CC(=O)c2ccc3c(c2)OCCO3)cc[n+]1C.[Br-]

nearest known ligand 0.52

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
ATM Q13315 1/20 0.52
THRB P10828 1/20 0.52
CTNNB1 P35222 5/20 0.51
WNT3A P56704 3/20 0.51
HPGD P15428 1/20 0.50
NPC1 O15118 5/20 0.49
RAB9A P51151 5/20 0.49
LMNA P02545 3/20 0.49
SMN1; SMN2 Q16637 5/20 0.48
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 3/20 0.48
TP53 P04637 3/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 1/20 0.47
USP2 O75604 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
KLF5 Q13887 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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 SCHEMBL3844660 0.79 CTNNB1 (0.36) ATMTHRBCTNNB1WNT3AHPGD
Bromide SCHEMBL3851136 0.78 SMN1; SMN2 (0.46) ATMNPC1RAB9ALMNASMN1; SMN2
Bromide SCHEMBL3850362 0.78 POLB (0.42) ATMTHRBNPC1RAB9ALMNA
Bromide SCHEMBL3847714 0.77 GSK3B (0.52) ATMHPGDNPC1RAB9ALMNA
Bromide SCHEMBL3846665 0.77 SMN1; SMN2 (0.46) HPGDNPC1RAB9ALMNASMN1; SMN2
Bromide SCHEMBL3849745 0.76 ATM (0.52) ATMTHRBNPC1RAB9ALMNA
Bromide SCHEMBL3845104 0.76 SMN1; SMN2 (0.60) RAB9ALMNASMN1; SMN2ALDH1A1MAPT
Bromide SCHEMBL3846585 0.76 KMT2A (0.45) NPC1RAB9ALMNASMN1; SMN2ALDH1A1
Bromide SCHEMBL4114910 0.74 THRB (0.64) ATMTHRBCTNNB1WNT3AHPGD
Bromide SCHEMBL3844623 0.74 KMT2A (0.47) NPC1RAB9ALMNASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085086-A2 Method for treating congestive heart failure or diabetic nephropathy Synvista Therapeutics, Inc. (US) 2009-08-05 EP disclosed
US-20090124673-A1 Method for treating diabetic nephropathy SYNVISTA THERAPEUTICS , INC. (US) 2009-05-14 US disclosed
US-20090124674-A1 Method for treating congestive heart failure SYNVISTA THERAPEUTICS, INC. (US) 2009-05-14 US disclosed
US-7432254-B2 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. (US) 2008-10-07 US disclosed
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents SYNVISTA THERAPEUTICS, INC. 2007-02-22 US disclosed
US-7166625-B2 Method for treating fibrotic diseases and other indications ALTEON, INC. (US) 2007-01-23 US disclosed
EP-1305024-A4 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON INC (US) 2006-03-22 EP disclosed
EP-1353669-A4 METHOD FOR TREATING GLAUCOMA IB ALTEON INC (US) 2005-10-19 EP disclosed
US-20040235837-A1 Method for treating fibrotic diseases or other indications IE SYNVISTA THERAPEUTICS, INC. 2004-11-25 US disclosed
EP-1353669-A1 METHOD FOR TREATING GLAUCOMA IB Alteon, Inc. (US) 2003-10-22 EP disclosed
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents ALTEON, INC. 2003-09-18 US disclosed
EP-1305024-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC Alteon, Inc. (US) 2003-05-02 EP disclosed
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID SYNVISTA THERAPEUTICS, INC. 2002-11-28 US disclosed
US-20020160993-A1 Method for treating glaucoma IC SYNVISTA THERAPEUTICS, INC. 2002-10-31 US disclosed
WO-2002053158-A1 METHOD FOR TREATING GLAUCOMA IB ALTEON, INC. (US) 2002-07-11 WO disclosed
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC ALTEON, INC. 2002-06-06 US disclosed
WO-2002007725-A1 METHOD FOR TREATING FIBROTIC DISEASES OR OTHER INDICATIONS IC ALTEON, INC. (US) 2002-01-31 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 (8 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-20040235837-A1 Method for treating fibrotic diseases or other indications IE MMP1, COL1A1, COL2A1 ATM 4372/4885THRB 3009/4885CTNNB1 3194/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 ATM 2711/4885THRB 3840/4885CTNNB1 3765/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 ATM 4212/4885THRB 3309/4885CTNNB1 3607/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 ATM 3775/4885THRB 4000/4885CTNNB1 3966/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 ATM 4427/4885THRB 3186/4885CTNNB1 4099/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 ATM 4200/4885THRB 2329/4885CTNNB1 3797/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX ATM 2462/4885THRB 3857/4885CTNNB1 4217/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 ATM 4780/4885THRB 2693/4885CTNNB1 3309/4885

“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.