SCHEMBL133672

SCHEMBL133672

CCCCCCCc1nc2ccccc2cc1O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 6/20 0.54
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
GAA P10253 2/20 0.49
HPGD P15428 2/20 0.49
STAT3 P40763 1/20 0.49
USP2 O75604 1/20 0.46
GLA P06280 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TRPV1 Q8NER1 4/20 0.43
KCNH2 Q12809 1/20 0.42

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
SCHEMBL2054396 0.98 TLR8 (0.55) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL570984 0.94 TLR8 (0.54) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL27870558 0.83 TLR8 (0.68) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL28793625 0.83 TLR8 (0.68) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL28743898 0.81 TLR8 (0.61) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL286920 0.81 TLR8 (0.54) TLR8TRPV1KCNH2
SCHEMBL287399 0.81 TLR8 (0.61) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL168398 0.81 TLR8 (0.69) TLR8KDM4EALDH1A1GAAHPGD
SCHEMBL2514453 0.81 TLR8 (0.56) TLR8ALDH1A1HPGDGLAMAPT
SCHEMBL1122100 0.81 RXFP1 (0.49) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134797-B1 BIOCIDAL/HYDROPHOBIC INNER COATING OF CONDENSER PIPES (OF INDUSTRIAL TURBINES AND SUBSIDIARY COOLING CYCLES) SIEMENS AG (DE) 2014-06-18 EP claimed
CN-105974044-B The method of N- acyl-homoserine lactone types of populations induction signal molecule in test sample 清华大学深圳研究生院 2018-12-25 CN disclosed
CN-107667288-A Spectral analysis of microorganisms 英国质谱公司 2018-02-06 CN disclosed
CN-105974044-A Method for detecting N-acyl-homoserine lactone quorum sensing signal molecules in sample 清华大学深圳研究生院 2016-09-28 CN disclosed
CN-101679802-B Biocidal/hydrophobic inner coating of condenser pipes (of industrial turbines and subsidiary cooling cycles) SIEMENS AG 2013-09-18 CN disclosed
US-20130011400-A1 Methods For Inducing Autolysis In Infectious Bacteria HAPTOGEN LTD. (GB) 2013-01-10 US disclosed
EP-1730197-B1 METHODS FOR INDUCING AUTOLYSIS IN INFECTIOUS BACTERIA HAPTOGEN LTD (GB) 2012-03-07 EP disclosed
US-20110027280-A1 Methods For Inducing Autolysis In Infectious Bacteria HAPTOGEN LTD. (GB) 2011-02-03 US disclosed
EP-2261260-A2 Methods for inducing autolysis in infectious bacteria Haptogen Ltd (GB) 2010-12-15 EP disclosed
CN-101679802-A Biocidal/hydrophobic inner coating of condenser pipes (of industrial turbines and subsidiary cooling cycles) SIEMENS AG 2010-03-24 CN disclosed
US-20100068457-A1 BIOCIDAL/HYDROPHOBIC INNER COATING OF CONDENSER PIPES (OF INDUSTRIAL TURBINES AND SUBSIDIARY COOLING CYCLES) SIEMENS AKTIENGESELLSCHAFT (DE) 2010-03-18 US disclosed
US-7651699-B2 novel way of controlling the dynamics of the rumen flora using the very compounds the natural microbial population produce themselves in feed PATHWAY INTERMEDIATES LIMITED (GB) 2010-01-26 US disclosed
US-20070218058-A1 Methods For Inducing Autolysis In Infectious Bacteria HAPTOGEN LTD. POLWARTH BUILDING (GB) 2007-09-20 US disclosed
EP-1361801-B1 AUTOINDUCER COMPOUNDS AND THEIR USES PATHWAY INTERMEDIATES LTD (GB) 2007-06-06 EP disclosed
EP-1730197-A2 METHODS FOR INDUCING AUTOLYSIS IN INFECTIOUS BACTERIA Haptogen Ltd (GB) 2006-12-13 EP disclosed
WO-2005094883-A2 METHODS FOR INDUCING AUTOLYSIS IN INFECTIOUS BACTERIA HAPTOGEN LTD (GB) 2005-10-13 WO disclosed
US-20040115245-A1 Autoinducer compounds and their uses GORMAR MARKETING LIMITED (KY) 2004-06-17 US disclosed
EP-1361801-A1 AUTOINDUCER COMPOUNDS AND THEIR USES Gormar Marketing Limited (KY) 2003-11-19 EP disclosed
WO-2002052949-A1 AUTOINDUCER COMPOUNDS AND THEIR USES GORMAR MARKETING LIMITED (KY) 2002-07-11 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 (3 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-20130011400-A1 Methods For Inducing Autolysis In Infectious Bacteria CFTR, ENPP2, BAD TLR8 57/4885KDM4E 4823/4885ALDH1A1 4798/4885
US-20110027280-A1 Methods For Inducing Autolysis In Infectious Bacteria CFTR, ENPP2, BAD TLR8 57/4885KDM4E 4823/4885ALDH1A1 4798/4885
US-20070218058-A1 Methods For Inducing Autolysis In Infectious Bacteria CFTR, BAD, ENPP2 TLR8 38/4885KDM4E 4846/4885ALDH1A1 4804/4885

“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.