Bromide

Bromide

SCHEMBL3854789

C[n+]1ccn(CC(=O)c2ccccc2C(F)(F)F)c1.[Br-]

nearest known ligand 0.60

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 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CTNNB1 P35222 10/20 0.45
WNT3A P56704 10/20 0.45
MEN1 O00255 1/20 0.41
RECQL P46063 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.39

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
SCHEMBL20527617 0.81 LMNA (0.53) LMNASMN1; SMN2CTNNB1WNT3AMEN1
SCHEMBL20527659 0.80 LMNA (0.55) LMNASMN1; SMN2CTNNB1WNT3AMEN1
Bromide SCHEMBL3845433 0.79 CTNNB1 (0.41) LMNASMN1; SMN2CTNNB1WNT3ARECQL
SCHEMBL20527501 0.76 LMNA (0.51) LMNASMN1; SMN2MEN1RECQLKMT2A
SCHEMBL20527503 0.76 LMNA (0.51) LMNASMN1; SMN2CTNNB1WNT3AMEN1
SCHEMBL11226784 0.72 CYP19A1 (0.49) CTNNB1WNT3A
Bromide SCHEMBL3850911 0.71 SMN1; SMN2 (0.74) LMNASMN1; SMN2MEN1RECQLKMT2A
Bromide SCHEMBL3845437 0.70 CTNNB1 (0.43) LMNACTNNB1WNT3ARECQLGAA
Bromide SCHEMBL3849689 0.70 SMN1; SMN2 (0.64) LMNASMN1; SMN2MEN1RECQLKMT2A
Bromide SCHEMBL10850394 0.70 SMN1; SMN2 (0.76) LMNASMN1; SMN2MEN1RECQLKMT2A

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 14 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
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
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
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 LMNA 1024/4885SMN1; SMN2 605/4885CTNNB1 3194/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 LMNA 2101/4885SMN1; SMN2 3940/4885CTNNB1 3765/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 LMNA 1032/4885SMN1; SMN2 549/4885CTNNB1 3607/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 LMNA 825/4885SMN1; SMN2 204/4885CTNNB1 3966/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 LMNA 1911/4885SMN1; SMN2 1693/4885CTNNB1 4099/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 LMNA 685/4885SMN1; SMN2 295/4885CTNNB1 3797/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX LMNA 473/4885SMN1; SMN2 306/4885CTNNB1 4217/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 LMNA 1815/4885SMN1; SMN2 2173/4885CTNNB1 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.