Bromide

Bromide

SCHEMBL20984367

Br.N#Cc1ccc(NN)c(C#N)c1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.42
GAA P10253 3/20 0.42
ALDH1A1 P00352 3/20 0.42
LRRK2 Q5S007 2/20 0.38
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
STS P08842 1/20 0.36
IMPDH2 P12268 1/20 0.36
IMPDH1 P20839 1/20 0.36
IDO1 P14902 2/20 0.34
CXCR2 P25025 3/20 0.34
CXCR1 P25024 2/20 0.34
KAT2B Q92831 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL28200136 0.98 ALDH1A1 (0.43) KDM4EGAAALDH1A1LRRK2LMNA
Hydrochloric Acid SCHEMBL20984507 0.96 KDM4E (0.42) KDM4EGAAALDH1A1LRRK2LMNA
Bromide SCHEMBL20984917 0.93 KDM4E (0.38) KDM4EGAAALDH1A1LRRK2LMNA
Oxalic Acid SCHEMBL20984936 0.88 CXCR2 (0.42) KDM4EGAAALDH1A1STSCXCR2
Sulfuric Acid SCHEMBL20984209 0.88 STS (0.41) KDM4EGAAALDH1A1LRRK2STS
Phosphoric Acid SCHEMBL20984966 0.88 MMP2 (0.40) KDM4EGAAALDH1A1LRRK2STS
Oxalic Acid SCHEMBL20984938 0.88 CXCR2 (0.42) KDM4EGAAALDH1A1STSCXCR2
Nitric Acid SCHEMBL20984350 0.85 KAT2B (0.43) KDM4EGAAALDH1A1LMNACXCR2
Bromide SCHEMBL20984939 0.84 KDM4E (0.39) KDM4EGAAALDH1A1LMNAL3MBTL1
SCHEMBL28200176 0.82 KDM4E (0.40) KDM4EGAAALDH1A1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11040938-B2 Continuous flow process for the synthesis of phenylhydrazine salts and substituted phenylhydrazine salts SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2021-06-22 US claimed
CN-107663161-B Continuous flow synthesis process of phenylhydrazine salt and substituted phenylhydrazine salt 上海惠和化德生物科技有限公司 2020-04-10 CN claimed
US-20190152896-A1 Continuous Flow Process For the Synthesis of Phenylhydrazine Salts and Substituted Phenylhydrazine Salts SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2019-05-23 US claimed
US-11040938-B2 Continuous flow process for the synthesis of phenylhydrazine salts and substituted phenylhydrazine salts SHANGHAI HYBRID-CHEM TECHNOLOGIES (CN) 2021-06-22 US disclosed
CN-107663161-B Continuous flow synthesis process of phenylhydrazine salt and substituted phenylhydrazine salt 上海惠和化德生物科技有限公司 2020-04-10 CN 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 (2 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-11040938-B2 Continuous flow process for the synthesis of phenylhydrazine salts and substituted phenylhydrazine salts HPD, TYR, PDK2 KDM4E 3035/4885GAA 237/4885ALDH1A1 379/4885
US-20190152896-A1 Continuous Flow Process For the Synthesis of Phenylhydrazine Salts and Substituted Phenylhydrazine Salts HPD, TYR, PDK2 KDM4E 3035/4885GAA 237/4885ALDH1A1 379/4885

“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.