Bromide

Bromide

SCHEMBL1005588

C=CC[N+]1(CC=C)CCOCC1.[Br-]

nearest known ligand 0.40

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 9)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.40
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
PLA2G1B P04054 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37

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
SCHEMBL3308553 0.97 CYP2D6 (0.41) CYP2D6MEN1USP2ALDH1A1PLA2G1B
Hydrochloric Acid SCHEMBL10546112 0.95 CYP2D6 (0.43) CYP2D6MEN1USP2ALDH1A1PLA2G1B
SCHEMBL3306688 0.84 CYP2D6 (0.38) CYP2D6MEN1USP2ALDH1A1PLA2G1B
Bromide SCHEMBL1066554 0.81 TSHR (0.33)
SCHEMBL3307555 0.81 CTDSP1 (0.39) CYP2D6
SCHEMBL2061000 0.78
SCHEMBL7123064 0.78 TSHR (0.35)
Bromide SCHEMBL11693696 0.78 TSHR (0.35) CYP2D6
SCHEMBL10771798 0.78 CYP2D6 (0.35) CYP2D6ALDH1A1
SCHEMBL3303638 0.78 CYP2D6 (0.35) CYP2D6ALDH1A1

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454327-B1 COLOR-CHANGING MATERIALS AND MULTIPLE COMPONENT MATERIALS HAVING A COLOR-CHANGING COMPOSITION KIMBERLY CLARK CO (US) 2015-04-15 EP claimed
US-20080076851-A1 Hydrophilic surface modification of contact lenses GOLDBERG EUGENE P 2008-03-27 US claimed
US-9788548-B2 Synthesis of pure diallyl morpholinium monomers in high yields and using antibacterial effect of their spiro polymers Tugrul Cem BICAK (TR) 2017-10-17 US disclosed
US-20160286809-A1 SYNTHESIS OF PURE DIALLYL MORPHOLINIUM MONOMERS IN HIGH YIELDS AND USING ANTIBACTERIAL EFFECT OF THEIR SPIRO POLYMERS BICAK, Tugrul Cem (TR) 2016-10-06 US disclosed
EP-1326704-B1 SURFACE-MODIFIED SEMICONDUCTIVE AND METALLIC NANOPARTICLES HAVING ENHANCED DISPERSIBILITY IN AQUEOUS MEDIA LIFE TECHNOLOGIES CORP (US) 2015-11-18 EP disclosed
WO-2015088464-A1 SYNTHESIS OF PURE DIALLYL MORPHOLINIUM MONOMERS IN HIGH YIELDS AND USING ANTIBACTERIAL EFFECT OF THEIR SPIRO POLYMERS BICAK TUGRUL CEM (TR) 2015-06-18 WO disclosed
EP-2454327-B1 COLOR-CHANGING MATERIALS AND MULTIPLE COMPONENT MATERIALS HAVING A COLOR-CHANGING COMPOSITION KIMBERLY CLARK CO (US) 2015-04-15 EP disclosed
US-8691384-B2 Metallic nanoparticles having enhanced dispersibility in aqueous media comprising a polymer having alkyl acrylamide side chains Life Technologies Corporation (US) 2014-04-08 US disclosed
US-8623290-B2 Color-changing materials and multiple component materials having a color-changing composition KIMBERLY-CLARK WORLDWIDE, INC. (US) 2014-01-07 US disclosed
US-20120328485-A1 Color-Changing Materials And Multiple Component Materials Having A Color-Changing Composition KIMBERLY-CLARK WORLDWIDE, INC. 2012-12-27 US disclosed
US-8273306-B2 Color-changing materials and multiple component materials having a color-changing composition KIMBERLY-CLARK WORLDWIDE, INC. (US) 2012-09-25 US disclosed
WO-1996026222-A1 AGGLOMERATED POLYMER PARTICLES FROM WATER-SWELLABLE POLYMERS, PROCESSES FOR PRODUCING SAID POLYMER PARTICLES AND THE USE OF SAID PARTICLES BASF AKTIENGESELLSCHAFT (DE) 1996-08-29 WO disclosed
EP-0412388-B1 Process of preparation of fine particles of polymers in powder form BASF AG (DE) 1995-10-04 EP disclosed
US-5346986-A Flocculants, retention and drainage aids BASF AKTIENGESELLSCHAFT (DE) 1994-09-13 US disclosed
EP-0528267-A1 Shock resistance modifying polymers BASF Aktiengesellschaft (DE) 1993-02-24 EP disclosed
WO-1992013912-A1 AGGLOMERATED POLYMER PARTICLES PRODUCED FROM FINELY DIVIDED WATER-SOLUBLE OR WATER-SWELLABLE POLYMERISATES BASF AKTIENGESELLSCHAFT (DE) 1992-08-20 WO disclosed
EP-0290753-B1 PROCESS FOR PREPARING POLYMER BEADS FROM WATER-SOLUBLE ETHYLENICALLY UNSATARATED MONOMERS BASF Aktiengesellschaft (DE) 1990-12-19 EP disclosed
WO-1990011304-A1 PROCESS FOR REDUCING THE RESIDUAL MONOMER CONTENT OF DIALLYL AMMONIUM SALT POLYMERS BASF AKTIENGESELLSCHAFT (DE) 1990-10-04 WO disclosed
US-4879361-A PAPERMAKING, FLOCCULATION, ABSORBTION BASF AKTIENGESELLSCHAFT (DE) 1989-11-07 US disclosed
EP-0290753-A1 Process for preparing polymer beads from water-soluble ethylenically unsatarated monomers BASF Aktiengesellschaft (DE) 1988-11-17 EP 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 (1 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-20160286809-A1 SYNTHESIS OF PURE DIALLYL MORPHOLINIUM MONOMERS IN HIGH YIELDS AND USING ANTIBACTERIAL EFFECT OF THEIR SPIRO POLYMERS SBDS, UROD, ADSL CYP2D6 1169/4885MEN1 4367/4885USP2 3286/4885

“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.