SCHEMBL1547096

SCHEMBL1547096

Cc1c(Br)c(Br)cc(Br)c1Br

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.44
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
CA1 P00915 1/20 0.43
CA6 P23280 1/20 0.43
AHR P35869 1/20 0.40
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
NQO2 P16083 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.31
AKR1B1 P15121 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL9376593 0.84 APEX1 (0.38) APEX1CA2CA4CA1CA6
SCHEMBL2266180 0.80 CA2 (0.40) APEX1CA2CA4CA1CA6
SCHEMBL7754486 0.80 CA1 (0.40) APEX1CA2CA4CA1CA6
SCHEMBL6690082 0.78 APEX1 (0.38) APEX1CA2CA4CA1CA6
SCHEMBL21218762 0.78 APEX1 (0.38) APEX1CA2CA4CA1CA6
SCHEMBL11547149 0.78 APEX1 (0.33) APEX1CA2CA4
Bromomethane SCHEMBL27669607 0.74 TDP1 (0.50) APEX1CA2CA4CA1CA6
Ethane SCHEMBL27516377 0.74 TDP1 (0.50) APEX1CA2CA4CA1CA6
SCHEMBL21218754 0.74 GAA (0.40) APEX1CA2CA4CA1CA6
SCHEMBL27584888 0.74 ACHE (0.43) APEX1CA2CA4CA1CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106117473-B A kind of sulfonated polyether-ether-ketone and its preparation method and application can be used as cross-linked proton exchange membrane material 杭州中科氢能科技有限公司 2018-12-07 CN claimed
CN-105884745-B nickel-carbene binuclear complex and preparation method and application thereof 中国科学院理化技术研究所 2018-06-19 CN claimed
CN-106117473-A A kind of can be as sulfonated polyether-ether-ketone of cross-linked proton exchange membrane material and its production and use 中国科学院上海高等研究院 2016-11-16 CN claimed
CN-105884745-A Nickel-carbene binuclear complex and preparation method and application thereof 中国科学院理化技术研究所 2016-08-24 CN claimed
CN-105238392-A Method for generating phosphorescence in organic compound UNIV NANCHANG 2016-01-13 CN claimed
CN-101481609-A Symmetrical multiphoton pump luminescent material and preparation thereof UNIV SOUTHEAST (CN) 2009-07-15 CN claimed
CN-100412129-C Method for preparing chemical crosslink gel lattice polymer electrolyte CHINESE ACAD INST CHEMISTRY (CN) 2008-08-20 CN claimed
CN-101024713-A Method for preparing chemical crosslink gel lattice polymer electrolyte CHINESE ACAD INST CHEMISTRY (CN) 2007-08-29 CN claimed
CN-115385956-A Biaryl diphosphine ligands and transition metal complexes thereof 东莞市均成高新材料有限公司 2022-11-25 CN disclosed
EP-2315502-B1 Electroluminescent device UDC IRELAND LTD (IE) 2020-10-14 EP disclosed
CN-106117473-B A kind of sulfonated polyether-ether-ketone and its preparation method and application can be used as cross-linked proton exchange membrane material 杭州中科氢能科技有限公司 2018-12-07 CN disclosed
CN-105884745-B nickel-carbene binuclear complex and preparation method and application thereof 中国科学院理化技术研究所 2018-06-19 CN disclosed
EP-2265092-B1 Electroluminescent device UDC IRELAND LTD (IE) 2018-03-14 EP disclosed
CN-107522646-A A kind of adjustable dendritic macromole fluorescent material of glow color and preparation method thereof 福建师范大学 2017-12-29 CN disclosed
US-20030228521-A1 Gel electrolyte precursor and chemical battery KABUSHIKI KAISHA TOSHIBA (JP) 2003-12-11 US disclosed
US-20030095958-A1 Inhibitors of bace VERTEX PHARMACEUTICALS INCORPORATED 2003-05-22 US disclosed
US-20030078353-A1 Aqueous room temperature living radical polymerization of vinyl halides UNIVERSITY OF PENNSYLVANIA 2003-04-24 US disclosed
US-20020173611-A1 Process for the living radical polymerization of chlorine containing monomers UNIVERSITY OF PENNSYLVANIA 2002-11-21 US disclosed
WO-2002088101-A2 INHIBITORS OF BACE VERTEX PHARMACEUTICALS INCORPORATED (US) 2002-11-07 WO disclosed
US-20010023041-A1 Gel electrolyte precursor and chemical battery KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-20 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-20030095958-A1 Inhibitors of bace BACE2, BACE1, APP APEX1 620/4885CA2 528/4885CA4 1200/4885

“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.