SCHEMBL1105809

SCHEMBL1105809

Cc1cc[n+](CCCCCC(=O)O)c2ccccc12

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.77
POLB P06746 1/20 0.77
RECQL P46063 1/20 0.56
MAPT P10636 3/20 0.46
HTT P42858 2/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.41
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
RXFP1 Q9HBX9 1/20 0.41

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
Bromide SCHEMBL3915979 0.99 KDM4E (0.80) KDM4EPOLBRECQLMAPTHTT
Iodide SCHEMBL2057098 0.99 KDM4E (0.75) KDM4EPOLBRECQLMAPTHTT
SCHEMBL15419914 0.99 KDM4E (0.79) KDM4EPOLBRECQLMAPTHTT
SCHEMBL16663887 0.94 KDM4E (0.81) KDM4EPOLBRECQLMAPTHTT
SCHEMBL8022993 0.88 KDM4E (0.97) KDM4EPOLBRECQLMAPTHTT
Iodide SCHEMBL29210094 0.87 KDM4E (0.94) KDM4EPOLBRECQLMAPTHTT
Bromide SCHEMBL8512189 0.87 KDM4E (1.00) KDM4EPOLBRECQLMAPTHTT
SCHEMBL13686278 0.87 KDM4E (0.62) KDM4EPOLBRECQLBCHEACHE
SCHEMBL13645489 0.85 KDM4E (0.64) KDM4EPOLBRECQLMAPTHTT
SCHEMBL7069818 0.84 KDM4E (0.54) KDM4EPOLBRECQLMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9850382-B1 Unsymmetrical cyanine dyes and their application Ying, Laiqiang (US) 2017-12-26 US disclosed
US-9850382-B1 Unsymmetrical cyanine dyes and their application Ying, Laiqiang (US) 2017-12-26 US disclosed
US-9670476-B2 Enzyme substrate comprising a functional dye and associated technology and methods BIOTIUM, INC. (US) 2017-06-06 US disclosed
US-20160237421-A9 ENZYME SUBSTRATE COMPRISING A FUNCTIONAL DYE AND ASSOCIATED TECHNOLOGY AND METHODS BIOTIUM, INC. (US) 2016-08-18 US disclosed
US-8846952-B2 Detection or quantification of desirable target molecules, novel dyes, composite dyes, and oligonucleotides or polynucleotides comprising such dyes ENZO LIFE SCIENCES, INC. (US) 2014-09-30 US disclosed
US-20140273151-A1 ENZYME SUBSTRATE COMPRISING A FUNCTIONAL DYE AND ASSOCIATED TECHNOLOGY AND METHODS BIOTIUM, INC. (US) 2014-09-18 US disclosed
US-8778627-B2 Enzyme substrate comprising a functional dye and associated technology and methods BIOTIUM, INC. (US) 2014-07-15 US disclosed
US-8759526-B2 Dyes, composite dyes, and oligonucleotides or polynucleotides comprising such dyes—useful or detection or quantification of desirable target molecules ENZO LIFE SCIENCES, INC. (US) 2014-06-24 US disclosed
US-8586325-B2 Enzyme substrate comprising a functional dye and associated technology and methods BIOTIUM, INC. (US) 2013-11-19 US disclosed
US-8574881-B2 Compositions useful for detection or quantification of desirable target molecules, novel dyes, composite dyes, and oligonucleotides or polynucleotides comprising such dyes ENZO LIFE SCIENCES, INC. (US) 2013-11-05 US disclosed
US-7569695-B2 Cyanine dyes substituted by electrophilic groups and/or nucleophilic groups including merocyanine, methine, oxazoline, oxonol, selenazole fluorescent, imidazoline, quinoline, indole, reactive and cationic dyes; labeling reagents for proteins and nucleic acids; genetic probes; amplification; hybridization ENZO LIFE SCIENCES, INC. (US) 2009-08-04 US disclosed
US-20090148386-A1 ENZYME SUBSTRATE COMPRISING A FUNCTIONAL DYE AND ASSOCIATED TECHNOLOGY AND METHODS BIOTIUM, INC. 2009-06-11 US disclosed
WO-2007100392-A2 ENZYME SUBSTRATE COMPRISING A FUNCTIONAL DYE AND ASSOCIATED TECHNOLOGY AND METHODS BIOTIUM, INC. (US) 2007-09-07 WO disclosed
US-7166715-B2 Nitro-substituted non-fluorescent asymmetric cyanine dye compounds APPLERA CORPORATION (US) 2007-01-23 US disclosed
US-20050233360-A1 Nucleic acid probes and methods to detect and/or quantify nucleic acid analytes PROLIGO, LLC (US) 2005-10-20 US disclosed
US-6902900-B2 Nucleic acid probes and methods to detect and/or quantify nucleic acid analytes PROLICO, LLC (US) 2005-06-07 US disclosed
EP-1442142-A2 NUCLEIC ACID PROBES AND METHODS TO DETECT AND/OR QUANTIFY NUCLEIC ACID ANALYTES Proligo LLC (US) 2004-08-04 EP disclosed
US-20030143591-A1 Nucleic acid probes and methods to detect and/or quantify nucleic acid analytes PROLIGO, LLC (US) 2003-07-31 US disclosed
EP-1318177-A2 Compound, in particular marker-dye, based on polymethines Dyomics GmbH (DE) 2003-06-11 EP disclosed
WO-2003043402-A2 NUCLEIC ACID PROBES AND METHODS TO DETECT AND/OR QUANTIFY NUCLEIC ACID ANALYTES PROLIGO LLC (US) 2003-05-30 WO 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-20030143591-A1 Nucleic acid probes and methods to detect and/or quantify nucleic acid analytes HLA-C, HLA-B, SLC43A3 KDM4E 4870/4885POLB 151/4885RECQL 1747/4885
US-20050233360-A1 Nucleic acid probes and methods to detect and/or quantify nucleic acid analytes HLA-C, HLA-B, SLC43A3 KDM4E 4870/4885POLB 151/4885RECQL 1747/4885

“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.