Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bromide SCHEMBL28874797 | 0.96 | — | — | |
| Bromide SCHEMBL368455 | 0.96 | TSHR (0.31) | — | |
| Bromide SCHEMBL463372 | 0.96 | TSHR (0.31) | — | |
| Bromide SCHEMBL368453 | 0.96 | TSHR (0.31) | — | |
| Hydrogen Sulfide SCHEMBL28090943 | 0.92 | TSHR (0.33) | — | |
| SCHEMBL197824 | 0.92 | TSHR (0.33) | — | |
| Fluoride Ion SCHEMBL1260645 | 0.88 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL20896 | 0.88 | TSHR (0.31) | — | |
| SCHEMBL596385 | 0.88 | TSHR (0.31) | — | |
| Lithium Ion SCHEMBL2504315 | 0.88 | TSHR (0.31) | — |
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 170 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230174687-A1 | PROCESS FOR THE PREPARATION OF BROMINATED COPOLYMERS OF CONJUGATED DIENES AND STYRENIC MONOMERS | LANXESS CORPORATION (US) | 2023-06-08 | — | — | US | claimed |
| US-8779066-B2 | Process for brominating butadiene polymers using ester solvent mixtures | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-07-15 | — | — | US | claimed |
| US-20140121330-A1 | PROCESS FOR BROMINATING BUTADIENE POLYMERS USING ESTER SOLVENT MIXTURES | THE DOW CHEMICAL COMPANY | 2014-05-01 | — | — | US | claimed |
| EP-2379605-B1 | PROCESS FOR BROMINATING BUTADIENE POLYMERS USING ESTER SOLVENT MIXTURES | DOW GLOBAL TECHNOLOGIES LLC (US) | 2014-03-12 | — | — | EP | claimed |
| US-8410226-B2 | Two-step process for brominating butadiene copolymers | DOW GLOBAL TECHNOLOGIES LLC (US) | 2013-04-02 | — | — | US | claimed |
| EP-2274338-B1 | TWO-STEP PROCESS FOR BROMINATING BUTADIENE COPOLYMERS | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-12-12 | — | — | EP | claimed |
| US-8193287-B2 | Process for brominating butadiene copolymers by the addition of water or certain solvents | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-06-05 | — | — | US | claimed |
| JP-2011528380-A | — | — | 2011-11-17 | — | — | JP | claimed |
| EP-2379605-A1 | PROCESS FOR BROMINATING BUTADIENE POLYMERS USING ESTER SOLVENT MIXTURES | Dow Global Technologies LLC (US) | 2011-10-26 | — | — | EP | claimed |
| JP-4726778-B2 | — | — | 2011-07-20 | — | — | JP | claimed |
| US-20100004402-A1 | Process for brominating butadiene/vinyl aromatic copolymers | THE DOW CHEMICAL COMPANY | 2010-01-07 | — | — | US | claimed |
| WO-2009139942-A2 | PROCESS FOR BROMINATING BUTADIENE COPOLYMERS BY THE ADDITION OF WATER OR CERTAIN SOLVENTS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2009-11-19 | — | — | WO | claimed |
| WO-2009134628-A1 | TWO-STEP PROCESS FOR BROMINATING BUTADIENE COPOLYMERS | DOW GLOBAL TECHNOLOGIES INC. (US) | 2009-11-05 | — | — | WO | claimed |
| US-7605267-B2 | Process for the preparation of 5-(halocetyl)-8-(substituted oxy)-(1h)-quinolin-2-ones | NOVARTIS AG (CH) | 2009-10-20 | — | — | US | claimed |
| EP-2054445-A2 | PROCESS FOR BROMINATING BUTADIENE/VINYL AROMATIC COPOLYMERS | Dow Global Technologies Inc. (US) | 2009-05-06 | — | — | EP | claimed |
| WO-2008021417-A2 | PROCESS FOR BROMINATING BUTADIENE/VINYL AROMATIC COPOLYMERS | DOW GLOBAL TECHNOLOGIES, INC. (US) | 2008-02-21 | — | — | WO | claimed |
| JP-2006522055-A | — | — | 2006-09-28 | — | — | JP | claimed |
| US-20060189653-A1 | Process for the preparation of 5-(halocetyl)-8-(substituted oxy)-(1h)-quinolin-2-ones | NOVARTIS AG (CH) | 2006-08-24 | — | — | US | claimed |
| EP-1613599-A1 | A PROCESS FOR THE PREPARATION OF 5-(HALOACETYL)-8-(SUBSTITUTED OXY)-(1H)-QUINOLIN-2-ONES | Novartis AG (CH) | 2006-01-11 | — | — | EP | claimed |
| WO-2004087668-A1 | A PROCESS FOR THE PREPARATION OF 5-(HALOACETYL)-8-(SUBSTITUTED OXY)-(1H)-QUINOLIN-2-ONES | NOVARTIS AG (CH) | 2004-10-14 | — | — | WO | claimed |