Bromide

Bromide

SCHEMBL7214859

CC[N+](CC)(CC)CCCO.[Br-]

nearest known ligand 0.55

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
DNM1 Q05193 4/20 0.55
ALDH1A1 P00352 3/20 0.41
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
HIF1A Q16665 1/20 0.41
NFKB1 P19838 1/20 0.39
KCNA1 Q09470 1/20 0.39
SLC22A1 O15245 2/20 0.38
SLC22A2 O15244 1/20 0.38
KDM4E B2RXH2 1/20 0.37
PMP22 Q01453 1/20 0.37
ATM Q13315 1/20 0.37
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL272419 0.97 DNM1 (0.52) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Iodide SCHEMBL14777716 0.94 DNM1 (0.50) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Hydrochloric Acid SCHEMBL14734829 0.94 DNM1 (0.50) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Water SCHEMBL319990 0.94 DNM1 (0.50) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Hydrochloric Acid SCHEMBL27408052 0.92 DNM1 (0.48) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
SCHEMBL11706247 0.91 DNM1 (0.46) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Bromide SCHEMBL17458752 0.89 DNM1 (0.64) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Water SCHEMBL3308247 0.88 DNM1 (0.43) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
SCHEMBL1686201 0.88 DNM1 (0.57) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10
Hydrochloric Acid SCHEMBL9003642 0.87 DNM1 (0.44) DNM1ALDH1A1TSHRSMN1; SMN2HSD17B10

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4038459-A BATTERY;WATER INSOLUBLE COMPLEX ECO-CONTROL, INC. (US) 1977-07-26 US claimed
CN-107151288-A It is a kind of for flotation agent of middle matter crude oil and preparation method thereof 天津亿利科能源科技发展股份有限公司 2017-09-12 CN disclosed
US-8658842-B2 Process for producing ethylene glycol catalyzed by ionic liquid INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2014-02-25 US disclosed
US-20130072727-A1 PROCESS FOR PRODUCING ETHYLENE GLYCOL CATALYZED BY IONIC LIQUID INSTITUTE OF PROCESS ENGINEERING, CHINESE ACADEMY OF SCIENCES (CN) 2013-03-21 US disclosed
US-6616920-B1 Copolymer of an acrylated or styrenized polysiloxane and a radical polymerizable monomer, especially an acrylic monomer containing an amine oxide or quaternium ammonium internal salt. MITSUBISHI CHEMICAL AMERICA, INC. 2003-09-09 US disclosed
US-5362485-A For setting or conditioning hair; softness, luster MITSUBISHI PETROCHEMICAL COMPANY, LTD. (JP) 1994-11-08 US disclosed
EP-0165333-B1 NEW COMPOUNDS CONTAINING QUATERNARY AMMONIUM AND METHYLENEPHOSPHONIC ACID GROUPS THE DOW CHEMICAL COMPANY (US) 1989-02-08 EP disclosed
US-4493771-A Scale inhibiting with compounds containing quaternary ammonium and methylenephosphonic acid groups THE DOW CHEMICAL COMPANY (US) 1985-01-15 US disclosed
US-4459241-A ANTIDEPOSIT AGENTS THE DOW CHEMICAL COMPANY (US) 1984-07-10 US disclosed
US-4147840-A Halogen complexing homotetra-alkyl salts for use in halogen cells ECO-CONTROL, INC. (US) 1979-04-03 US disclosed
US-4104447-A BATTERIES ECO-CONTROL, INC. (US) 1978-08-01 US 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-20130072727-A1 PROCESS FOR PRODUCING ETHYLENE GLYCOL CATALYZED BY IONIC LIQUID AGL, ALKBH3, ELL DNM1 2294/4885ALDH1A1 1764/4885TSHR 3995/4885

“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.