Bromide

Bromide

SCHEMBL3846665

Cc1n(CC(=O)c2ccc3ccccc3c2)cc[n+]1C.[Br-]

nearest known ligand 0.46

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
ACHE known ✓ P22303 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.46
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.46
LMNA P02545 2/20 0.46
PTPN1 P18031 1/20 0.46
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
JAK2 O60674 1/20 0.43
MAPT P10636 1/20 0.43
HKDC1 Q2TB90 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CDYL Q9Y232 7/20 0.43
CBX7 O95931 6/20 0.43
CDYL2 Q8N8U2 5/20 0.43
CDY1; CDY1B Q9Y6F8 5/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42

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 SCHEMBL3851136 0.81 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KDM4ELMNANPC1
Hydrochloric Acid SCHEMBL3849007 0.81 KMT2A (0.48) SMN1; SMN2KDM4EHPGDLMNANPC1
Bromide SCHEMBL3850362 0.81 POLB (0.42) SMN1; SMN2ALDH1A1LMNANPC1RAB9A
Bromide SCHEMBL3845737 0.80 CDYL2 (0.52) SMN1; SMN2ALDH1A1KDM4EHPGDNPC1
Bromide SCHEMBL3844623 0.79 KMT2A (0.47) SMN1; SMN2ALDH1A1KDM4ELMNANPC1
Bromide SCHEMBL3845104 0.79 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1LMNARAB9AMAPT
Bromide SCHEMBL3849745 0.79 ATM (0.52) SMN1; SMN2ALDH1A1KDM4ELMNAPTPN1
Bromide SCHEMBL3849689 0.78 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
Bromide SCHEMBL3846654 0.77 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1KDM4EHPGDLMNA
Bromide SCHEMBL3846936 0.75 PTPN1 (0.44) SMN1; SMN2ALDH1A1LMNAPTPN1MAPT

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-20090124674-A1 Method for treating congestive heart failure SYNVISTA THERAPEUTICS, INC. (US) 2009-05-14 US disclosed
US-20090124673-A1 Method for treating diabetic nephropathy 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 ACHE 1566/4885SMN1; SMN2 605/4885ALDH1A1 175/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 ACHE 32/4885SMN1; SMN2 3940/4885ALDH1A1 366/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 ACHE 1413/4885SMN1; SMN2 549/4885ALDH1A1 204/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 ACHE 2654/4885SMN1; SMN2 204/4885ALDH1A1 192/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 ACHE 1116/4885SMN1; SMN2 1693/4885ALDH1A1 402/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 ACHE 1945/4885SMN1; SMN2 295/4885ALDH1A1 261/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX ACHE 2361/4885SMN1; SMN2 306/4885ALDH1A1 431/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 ACHE 657/4885SMN1; SMN2 2173/4885ALDH1A1 448/4885

“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.