Bromide

Bromide

SCHEMBL3850355

CCN(CC)c1ccc(C(=O)C[n+]2csc(CCO)c2C)cc1.[Br-]

nearest known ligand 0.49

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
OPRM1 known ✓ P35372 1/20 0.49
OPRD1 P41143 1/20 0.49
KMT2A Q03164 5/20 0.48
MAPT P10636 8/20 0.45
ALDH1A1 P00352 4/20 0.45
POLB P06746 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
CCR6 P51684 1/20 0.45
GPR55 Q9Y2T6 1/20 0.45
MEN1 O00255 4/20 0.45
PLA2G1B P04054 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45
NPSR1 Q6W5P4 6/20 0.44
KDM4E B2RXH2 1/20 0.44
RECQL P46063 1/20 0.44
L3MBTL1 Q9Y468 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 SCHEMBL2946955 0.83 KMT2A (0.70) OPRM1OPRD1KMT2AMAPTALDH1A1
Bromide SCHEMBL3843860 0.83 MITF (0.57) OPRM1OPRD1KMT2AMAPTALDH1A1
Bromide SCHEMBL2947503 0.83 OPRM1 (0.64) OPRM1OPRD1KMT2AMAPTALDH1A1
SCHEMBL6935005 0.82 MITF (0.55) OPRM1OPRD1KMT2AMAPTALDH1A1
SCHEMBL6939126 0.82 KMT2A (0.67) OPRM1OPRD1KMT2AMAPTALDH1A1
Hydrochloric Acid SCHEMBL3853841 0.82 KMT2A (0.64) OPRM1OPRD1KMT2AMAPTALDH1A1
SCHEMBL6937914 0.81 OPRM1 (0.61) OPRM1OPRD1KMT2AMAPTALDH1A1
Bromide SCHEMBL3844426 0.81 OPRM1 (0.53) OPRM1OPRD1KMT2AMAPTALDH1A1
Bromide SCHEMBL3853607 0.81 OPRM1 (0.48) OPRM1OPRD1KMT2AMAPTALDH1A1
SCHEMBL6935373 0.80 OPRM1 (0.52) OPRM1OPRD1KMT2AMAPTALDH1A1

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 13 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
EP-1353669-B1 METHOD FOR TREATING GLAUCOMA ALTEON INC (US) 2007-08-15 EP 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
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 (6 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 OPRM1 3301/4885OPRD1 3051/4885KMT2A 4599/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 OPRM1 2517/4885OPRD1 2579/4885KMT2A 4535/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 OPRM1 3255/4885OPRD1 3200/4885KMT2A 4545/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 OPRM1 1647/4885OPRD1 1945/4885KMT2A 4493/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 OPRM1 3035/4885OPRD1 2604/4885KMT2A 4326/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 OPRM1 1579/4885OPRD1 2285/4885KMT2A 4520/4885

“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.