SCHEMBL1680334

SCHEMBL1680334

C=CC[n+]1ccn(CCCCC)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
HSP90AA1 P07900 2/20 0.54
KMT2A Q03164 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
APAF1 O14727 1/20 0.51
NPC1 O15118 1/20 0.51
PLA2G1B P04054 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
HTT P42858 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ATG4B Q9Y4P1 1/20 0.51
FDPS P14324 17/20 0.47

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
SCHEMBL29271983 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL4358561 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Bromide SCHEMBL4364814 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL2693557 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL15901605 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL23698402 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL28548851 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
SCHEMBL3398652 0.98 MEN1 (0.56) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Iodide SCHEMBL15008778 0.98 MEN1 (0.52) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1
Bromide SCHEMBL15901519 0.97 MEN1 (0.55) MEN1HSP90AA1KMT2ASMN1; SMN2APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117866290-A Antistatic agent based on ionic compound exchange reaction and preparation method thereof 浙江东吴新材料股份有限公司 2024-04-12 CN claimed
US-9018777-B2 Light-emitting-element encapsulating composition, light-emitting diode and liquid crystal display device LG CHEM, LTD. (KR) 2015-04-28 US claimed
US-20140185274-A1 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID CRYSTAL DISPLAY DEVICE LG CHEM, LTD. (KR) 2014-07-03 US claimed
US-8716395-B2 Light-emitting-element encapsulating composition, light-emitting diode and liquid-crystal display device LG CHEM, LTD. (KR) 2014-05-06 US claimed
US-20120168781-A1 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID-CRYSTAL DISPLAY DEVICE LG CHEM LTD. (KR) 2012-07-05 US claimed
EP-2458594-A2 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID-CRYSTAL DISPLAY DEVICE LG Chem, Ltd. (KR) 2012-05-30 EP claimed
EP-2458594-B1 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID-CRYSTAL DISPLAY DEVICE LG CHEMICAL LTD (KR) 2018-01-10 EP disclosed
US-20160181664-A1 ELECTROLYTE FOR SODIUM ION SECONDARY BATTERY TOYO GOSEI CO., LTD. (JP) 2016-06-23 US disclosed
US-9018777-B2 Light-emitting-element encapsulating composition, light-emitting diode and liquid crystal display device LG CHEM, LTD. (KR) 2015-04-28 US disclosed
US-20140185274-A1 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID CRYSTAL DISPLAY DEVICE LG CHEM, LTD. (KR) 2014-07-03 US disclosed
EP-1721900-B1 NOVEL IMIDAZOLIUM COMPOUND KANTO KAGAKU (JP) 2014-06-11 EP disclosed
US-8716395-B2 Light-emitting-element encapsulating composition, light-emitting diode and liquid-crystal display device LG CHEM, LTD. (KR) 2014-05-06 US disclosed
US-20120168781-A1 LIGHT-EMITTING-ELEMENT ENCAPSULATING COMPOSITION, LIGHT-EMITTING DIODE AND LIQUID-CRYSTAL DISPLAY DEVICE LG CHEM LTD. (KR) 2012-07-05 US disclosed
US-7731762-B2 Dye composition and dyeing method FUJIFILM CORPORATION (JP) 2010-06-08 US disclosed
EP-2159242-A1 SEALING AGENT FOR OPTICAL SEMICONDUCTOR ELEMENT, AND OPTICAL SEMICONDUCTOR ELEMENT Sekisui Chemical Co., Ltd. (JP) 2010-03-03 EP disclosed
US-7517999-B2 needs no complicated operations for dissolution and has excellent handleability and a high ionic conductivity, electrolytes; 1-butyl-3-allylimidazolium bromide KANTO KAGAKU KABUSHIKI KAISHA (JP) 2009-04-14 US disclosed
US-20090021558-A1 Liquid discharge apparatus and method for producing liquid discharge apparatus BROTHER KOGYO KABUSHIKI KAISHA 2009-01-22 US disclosed
US-20090020327-A1 Wiring unit, method for producing wiring unit, liquid jetting apparatus, and method for producing liquid jetting apparatus BROTHER KOGYO KABUSHIKI KAISHA 2009-01-22 US disclosed
US-20070191612-A1 Needs no complicated operations for dissolution and has excellent handleability and a high ionic conductivity, electrolytes; 1-butyl-3-allylimidazolium bromide HIROYUKI OHNO (JP) 2007-08-16 US disclosed
EP-1721900-A1 NOVEL IMIDAZOLIUM COMPOUND Kanto Kagaku Kabushiki Kaisha (JP) 2006-11-15 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-20070191612-A1 Needs no complicated operations for dissolution and has excellent handleability and a high ionic conductivity, electrolytes; 1-butyl-3-allylimidazolium bromide SLC26A3, KCNJ11, SLC26A4 MEN1 636/4885HSP90AA1 3528/4885KMT2A 4733/4885

“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.