Bromide

Bromide

SCHEMBL3844623

COc1ccc(C(=O)Cn2cc[n+](C)c2C)cc1.[Br-]

nearest known ligand 0.48

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
▸ KMT2A Q03164 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ NPC1 O15118 5/20 0.46
▸ LMNA P02545 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ GAA P10253 3/20 0.45
▸ MGAM O43451 2/20 0.45
▸ AMY1A P0DUB6 2/20 0.45
▸ SI P14410 2/20 0.45
▸ MGAM2 Q2M2H8 2/20 0.45
▸ GSK3B P49841 1/20 0.45
▸ HDAC3 O15379 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45
▸ HDAC11 Q96DB2 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45

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 0.86 SMN1; SMN2 (0.46) KMT2AALDH1A1NPC1LMNAKDM4E
Bromide SCHEMBL3845737 0.85 CDYL2 (0.52) KMT2AALDH1A1NPC1KDM4ERAB9A
Bromide SCHEMBL3846585 0.83 KMT2A (0.45) KMT2AALDH1A1NPC1LMNAKDM4E
Bromide SCHEMBL3849745 0.83 ATM (0.52) KMT2AALDH1A1NPC1LMNAKDM4E
Bromide SCHEMBL3845104 0.83 SMN1; SMN2 (0.60) KMT2AALDH1A1LMNAGAAMGAM
Bromide SCHEMBL3843753 0.81 KMT2A (0.49) KMT2AALDH1A1KDM4ERAB9AMEN1
Bromide SCHEMBL3844954 0.81 RAB9A (0.51) KMT2AALDH1A1NPC1LMNAKDM4E
SCHEMBL20527633 0.81 CA1 (0.46) KMT2AALDH1A1NPC1LMNAKDM4E
Hydrochloric Acid SCHEMBL3849007 0.80 KMT2A (0.48) KMT2ANPC1LMNAKDM4EGAA
Bromide SCHEMBL3846936 0.80 PTPN1 (0.44) ALDH1A1LMNAGSK3BHDAC1HDAC8

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 KMT2A 4599/4885ALDH1A1 175/4885NPC1 283/4885
US-20020160993-A1 Method for treating glaucoma IC CHAT, MYOC, GAP43 KMT2A 4535/4885ALDH1A1 366/4885NPC1 116/4885
US-20020068729-A1 Method for treating fibrotic diseases or other indications IC MMP1, COL1A1, COL2A1 KMT2A 4545/4885ALDH1A1 204/4885NPC1 205/4885
US-20030176426-A1 Method for treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, COL2A1 KMT2A 4051/4885ALDH1A1 192/4885NPC1 408/4885
US-20090124673-A1 Method for treating diabetic nephropathy REN, SLC5A2, SLC5A1 KMT2A 4493/4885ALDH1A1 402/4885NPC1 530/4885
US-20020177586-A1 Method for treating fibrotic diseases or other indications ID MMP1, COL1A1, COL2A1 KMT2A 4326/4885ALDH1A1 261/4885NPC1 347/4885
US-20070043016-A1 Method of treating fibrotic diseases or other indications with imidazolium agents MMP1, COL1A1, EPX KMT2A 4075/4885ALDH1A1 431/4885NPC1 598/4885
US-20090124674-A1 Method for treating congestive heart failure TNNI3, TNNT2, FABP3 KMT2A 4520/4885ALDH1A1 448/4885NPC1 515/4885

“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.

Send feedback