SCHEMBL13636812

SCHEMBL13636812

Fc1cc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(C(F)(F)F)c(F)c4)cc3)c3ccc(/C=C/c4ccc(C(F)(F)F)c(F)c4)cc3)cc2)ccc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 5/20 0.46
APP P05067 2/20 0.42
NFE2L2 Q16236 3/20 0.41
NQO2 P16083 1/20 0.38
KCNH2 Q12809 2/20 0.37
MAT2A P31153 1/20 0.37
KDM1A O60341 1/20 0.36
MAPT P10636 1/20 0.35
AHR P35869 1/20 0.35

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
SCHEMBL13639131 0.91 NFE2L2 (0.41) KIF11APPNFE2L2KCNH2MAT2A
SCHEMBL13978824 0.86 APP (0.49) KIF11APPNFE2L2NQO2AHR
SCHEMBL13636757 0.85 PTGS1 (0.45) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL13636779 0.81 PTGS1 (0.40) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL13636747 0.80 NFE2L2 (0.62) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL13636752 0.76 TUBB1 (0.50) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL20740835 0.75 KIF11 (0.56) KIF11KDM1A
SCHEMBL13978808 0.75 NFE2L2 (0.52) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL13636762 0.75 PTGS1 (0.49) APPNFE2L2NQO2KCNH2MAT2A
SCHEMBL21402590 0.74 KIF11 (0.56) KIF11APPKDM1AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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

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 KIF11 1688/4885APP 2549/4885NFE2L2 423/4885

“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.