SCHEMBL13636755

SCHEMBL13636755

Fc1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(F)cc4)cc3)c3ccc(/C=C/c4ccc(F)cc4)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.68
NFE2L2 Q16236 8/20 0.58
PTGS1 P23219 2/20 0.50
HSD11B1 P28845 1/20 0.46
KDM4A O75164 2/20 0.46
KDM2A Q9Y2K7 2/20 0.46
NQO2 P16083 1/20 0.45
ALOX5 P09917 1/20 0.45
PTGS2 P35354 1/20 0.45
FBP1 P09467 1/20 0.43

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
SCHEMBL13808677 0.93 APP (0.61) APPNFE2L2PTGS1HSD11B1KDM4A
SCHEMBL13992019 0.93 APP (0.61) APPNFE2L2PTGS1HSD11B1KDM4A
SCHEMBL16935868 0.91 NFE2L2 (0.68) APPNFE2L2PTGS1KDM4AKDM2A
SCHEMBL16935870 0.91 NFE2L2 (0.68) APPNFE2L2PTGS1KDM4AKDM2A
SCHEMBL19253327 0.89 APP (0.57) APPNFE2L2PTGS1HSD11B1KDM4A
SCHEMBL13636814 0.89 NFE2L2 (0.76) APPNFE2L2PTGS1KDM4AKDM2A
SCHEMBL17011126 0.89 APP (0.57) APPNFE2L2PTGS1HSD11B1KDM4A
SCHEMBL13900005 0.84 NFE2L2 (0.55) APPNFE2L2NQO2
SCHEMBL13636750 0.84 APP (0.50) APPNFE2L2PTGS1NQO2ALOX5
SCHEMBL4305587 0.84 APP (0.44) APPNFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957605-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-01-11 EP disclosed
EP-1957603-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-10-14 EP disclosed
US-8785001-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 US disclosed
US-8785001-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 US disclosed
US-8304095-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-8304095-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-20080297037-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-04 US disclosed
US-20080297037-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-04 US disclosed
US-20080272693-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-11-06 US disclosed
US-20080272693-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-11-06 US disclosed
WO-2007065549-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-06-14 WO disclosed
WO-2007065547-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-06-14 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 (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-20080272693-A1 Organic Electroluminescent Devices EML4, MT-ND4L, EPCAM APP 2549/4885NFE2L2 423/4885PTGS1 4105/4885

“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.