Bromide

Bromide

SCHEMBL3849528

C[c+]1n(C)ccn1CC(=O)c1c(Cl)cccc1Cl.[Br-]

nearest known ligand 0.41

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
FEN1 P39748 1/20 0.41
ALDH1A1 P00352 2/20 0.37
HPGD P15428 3/20 0.33
NPC1 O15118 1/20 0.33
GLA P06280 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
ITGB1 P05556 3/20 0.33
ITGA4 P13612 3/20 0.33
ITGB7 P26010 3/20 0.33
ALDH2 P05091 1/20 0.33
ELANE P08246 1/20 0.32
CXCR3 P49682 2/20 0.32
NOTUM Q6P988 1/20 0.32
AKR1B1 P15121 1/20 0.31
MEN1 O00255 1/20 0.31
CRHBP P24387 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
CRHR2 Q13324 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 SCHEMBL3846592 0.78 CXCR3 (0.44) ALDH1A1NPC1LMNACXCR3MEN1
Hydrochloric Acid SCHEMBL3853586 0.76 KDM4E (0.46) ALDH1A1HPGDLMNAMAPK1MEN1
Hydrochloric Acid SCHEMBL3848631 0.74 ALDH1A1 (0.50) FEN1ALDH1A1NPC1LMNAMAPK1
Hydrochloric Acid SCHEMBL3849010 0.74 GSK3B (0.44) ALDH1A1HPGDNPC1LMNAMAPK1
Bromide SCHEMBL3846659 0.73 PTPN1 (0.48) ALDH1A1HPGDLMNAMAPK1MEN1
Bromide SCHEMBL3845106 0.72 SMN1; SMN2 (0.49) ALDH1A1HPGDNPC1LMNAMAPK1
Bromide SCHEMBL3853764 0.70 NPC1 (0.47) ALDH1A1HPGDNPC1LMNAMAPK1
Bromide SCHEMBL3850368 0.69 CES2 (0.41) ALDH1A1HPGDNPC1MEN1HTT
Bromide SCHEMBL3846943 0.69 PTPN1 (0.46) ALDH1A1
SCHEMBL8239577 0.66 FEN1 (0.57) FEN1ALDH1A1HPGDNPC1GLA

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 11 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
US-20040235837-A1 Method for treating fibrotic diseases or other indications IE SYNVISTA THERAPEUTICS, INC. 2004-11-25 US disclosed
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents ALTEON, INC. 2003-09-18 US 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
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC ALTEON, INC. 2002-06-06 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 (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 FEN1 1342/4885ALDH1A1 175/4885HPGD 249/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 FEN1 3380/4885ALDH1A1 366/4885HPGD 667/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 FEN1 1857/4885ALDH1A1 204/4885HPGD 464/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 FEN1 440/4885ALDH1A1 192/4885HPGD 1031/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 FEN1 2512/4885ALDH1A1 402/4885HPGD 462/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 FEN1 1860/4885ALDH1A1 261/4885HPGD 287/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX FEN1 1433/4885ALDH1A1 431/4885HPGD 829/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 FEN1 4043/4885ALDH1A1 448/4885HPGD 118/4885

“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.