SCHEMBL3170230

SCHEMBL3170230

CCOC(=O)Cn1nc(C)cc1C

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 4/20 0.57
PKM P14618 1/20 0.57
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
POLB P06746 2/20 0.49
CYP2C19 P33261 1/20 0.49
APAF1 O14727 1/20 0.49
KMT2A Q03164 1/20 0.48

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
SCHEMBL17665629 0.86 LMNA (0.55) LMNAALDH1A1KDM4EPKMRAB9A
SCHEMBL26928039 0.85 NPC1 (0.52) LMNAALDH1A1KDM4EPKMNPC1
SCHEMBL26926832 0.85 MAPK1 (0.49) LMNAALDH1A1KDM4ENPC1SMN1; SMN2
SCHEMBL20037188 0.84 LMNA (0.66) LMNAALDH1A1KDM4EPKMRAB9A
SCHEMBL21806760 0.83 KDM4E (0.58) LMNAALDH1A1KDM4ENPC1RAB9A
SCHEMBL13172793 0.83 NPC1 (0.51) LMNAALDH1A1KDM4EPKMNPC1
SCHEMBL15656246 0.83 ALDH1A1 (0.61) LMNAALDH1A1KDM4ENPC1RAB9A
SCHEMBL19086973 0.83 MAPK1 (0.51) LMNAALDH1A1KDM4EPKMNPC1
SCHEMBL25062617 0.82 LMNA (0.58) LMNAALDH1A1KDM4EPKMRAB9A
SCHEMBL22118978 0.82 TSHR (0.48) LMNAALDH1A1KDM4ESMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9855260-B2 Quinolinone derivatives GLAXOSMITHKLINE LLC (US) 2018-01-02 US disclosed
US-9855260-B2 Quinolinone derivatives GLAXOSMITHKLINE LLC (US) 2018-01-02 US disclosed
EP-2712616-B1 Intermediates for the preparation of 1-(acetyl)-piperidine and 1-(acetyl)-piperazine derivatives as fungicides for use in plant protection DU PONT (US) 2017-04-19 EP disclosed
CN-103517896-B (E)-3-(3-Acetyl-4-hydroxy-5-methoxy-phenyl)-N-(4-hydroxy-1-methyl-3-octyloxy-2-oxo-1,2-dihydro-quinolin-7-yl)-acrylamide 葛兰素史密斯克莱有限责任公司 2016-09-21 CN disclosed
US-20150238480-A1 QUINOLINONE DERIVATIVES GLAXOSMITHKLINE LLC 2015-08-27 US disclosed
US-20150238480-A1 QUINOLINONE DERIVATIVES GLAXOSMITHKLINE LLC 2015-08-27 US disclosed
US-20150238480-A1 QUINOLINONE DERIVATIVES GLAXOSMITHKLINE LLC 2015-08-27 US disclosed
US-9061998-B2 Quinolinone derivatives GLAXOSMITHKLINE LLC (US) 2015-06-23 US disclosed
US-9061998-B2 Quinolinone derivatives GLAXOSMITHKLINE LLC (US) 2015-06-23 US disclosed
US-9061998-B2 Quinolinone derivatives GLAXOSMITHKLINE LLC (US) 2015-06-23 US disclosed
EP-1448218-A4 BETA-SECRETASE INHIBITORS AND METHODS OF USE OKLAHOMA MED RES FOUND (US) 2009-01-14 EP disclosed
EP-1996588-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS Torrent Pharmaceuticals Ltd (IN) 2008-12-03 EP disclosed
WO-2007100295-A1 NOVEL DUAL ACTION RECEPTORS ANTAGONISTS (DARA) AT THE ATI AND ETA RECEPTORS TORRENT PHARMACEUTICALS LTD (IN) 2007-09-07 WO disclosed
US-20060234944-A1 Beta-secretase inhibitors and methods of use OKLAHOMA MEDICAL RESEACH FOUNDATION (US) 2006-10-19 US disclosed
EP-1448218-A2 BETA-SECRETASE INHIBITORS AND METHODS OF USE Oklahoma Medical Research Foundation (US) 2004-08-25 EP disclosed
US-20040121947-A1 Compounds which inhibit beta-secretase activity and methods of use thereof OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2004-06-24 US disclosed
US-20040121947-A1 Compounds which inhibit beta-secretase activity and methods of use thereof OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2004-06-24 US disclosed
US-20040121947-A1 Compounds which inhibit beta-secretase activity and methods of use thereof OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2004-06-24 US disclosed
WO-2003039454-A2 BETA-SECRETASE INHIBITORS AND METHODS OF USE OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2003-05-15 WO disclosed
WO-2003039454-A2 BETA-SECRETASE INHIBITORS AND METHODS OF USE OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2003-05-15 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-20150238480-A1 QUINOLINONE DERIVATIVES PRKAG2, PRKAB2, PRKAG1 LMNA 2562/4885ALDH1A1 1140/4885KDM4E 2470/4885
US-20060234944-A1 Beta-secretase inhibitors and methods of use BACE2, BACE1, PSEN2 LMNA 470/4885ALDH1A1 4645/4885KDM4E 2181/4885
US-20040121947-A1 Compounds which inhibit beta-secretase activity and methods of use thereof BACE2, BACE1, PSEN2 LMNA 505/4885ALDH1A1 4517/4885KDM4E 2106/4885

“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.